Marvin 02101211082D 86 94 0 0 0 0 999 V2000 11.2992 -3.4004 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.2992 -4.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5848 -4.6378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5848 -5.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8703 -5.8754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8703 -6.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5848 -7.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5848 -7.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8703 -8.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1558 -7.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1558 -7.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4414 -6.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4414 -5.8754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7270 -7.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0125 -6.7003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0125 -5.8754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -5.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -4.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5836 -4.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8691 -4.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8691 -5.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5836 -5.8754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5836 -6.7003 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5836 -7.5253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4086 -6.7003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7586 -6.7003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7270 -7.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4414 -8.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0125 -8.3503 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -8.7628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4249 -9.0648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 -7.6358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2992 -8.3503 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.0137 -8.7628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8867 -9.0648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7117 -7.6358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2992 -5.8754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0137 -5.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7281 -5.8754 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0137 -4.6378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4426 -5.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4426 -4.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1572 -5.8753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1571 -4.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8716 -5.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8716 -4.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5861 -4.2253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.0151 -6.7002 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 17.0151 -5.8753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7295 -5.4628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.7295 -4.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4439 -4.2253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.4439 -3.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7295 -2.9878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7295 -2.1628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4439 -1.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1584 -2.1628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1584 -2.9878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8728 -3.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8728 -4.2253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5873 -2.9878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3018 -3.4003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.3018 -4.2253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.0163 -4.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0163 -5.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7306 -5.8753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4451 -5.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4451 -4.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7306 -4.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7306 -3.4003 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 22.7306 -2.5753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9057 -3.4003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.5556 -3.4003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5873 -2.1628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8728 -1.7504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3018 -1.7504 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 22.0163 -1.3379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8892 -1.0358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.7143 -2.4648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0151 -1.7504 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.3006 -1.3379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4276 -1.0358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6026 -2.4648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0151 -4.2253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3006 -4.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3006 -5.4628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 6 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 15 14 1 4 0 0 0 15 16 2 0 0 0 0 16 17 1 4 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 17 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 23 26 2 0 0 0 0 14 27 1 0 0 0 0 27 28 2 0 0 0 0 10 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 29 32 2 0 0 0 0 8 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 2 0 0 0 0 33 36 2 0 0 0 0 4 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 2 40 1 0 0 0 0 42 41 1 0 0 0 0 43 41 2 0 0 0 0 44 42 2 0 0 0 0 45 43 1 0 0 0 0 46 44 1 0 0 0 0 46 45 2 0 0 0 0 39 41 1 0 0 0 0 46 47 1 0 0 0 0 48 49 1 0 0 0 0 49 50 2 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 2 0 0 0 0 54 55 1 0 0 0 0 55 56 2 0 0 0 0 56 57 1 0 0 0 0 57 58 2 0 0 0 0 53 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 59 61 2 0 0 0 0 62 61 1 4 0 0 0 62 63 2 0 0 0 0 63 64 1 4 0 0 0 64 65 2 0 0 0 0 65 66 1 0 0 0 0 66 67 2 0 0 0 0 67 68 1 0 0 0 0 68 69 2 0 0 0 0 64 69 1 0 0 0 0 69 70 1 0 0 0 0 70 71 1 0 0 0 0 70 72 2 0 0 0 0 70 73 2 0 0 0 0 61 74 1 0 0 0 0 74 75 2 0 0 0 0 57 75 1 0 0 0 0 74 76 1 0 0 0 0 76 77 1 0 0 0 0 76 78 2 0 0 0 0 76 79 2 0 0 0 0 55 80 1 0 0 0 0 80 81 1 0 0 0 0 80 82 2 0 0 0 0 80 83 2 0 0 0 0 51 84 2 0 0 0 0 84 85 1 0 0 0 0 85 47 1 0 0 0 0 85 86 2 0 0 0 0 49 86 1 0 0 0 0 M END > CHEBI:63886 > Reactive red 120 > A bis(azo) compound that consists of a benzene core having two (4-amino-6-chloro-1,3,5-triazin-2-yl)amino groups attached at positions 1 and 4 and which in turn have 5-hydroxy-6-[(2-sulfophenyl)diazenyl]-2,7-disulfonaphthalen-4-yl groups attached to their 4-amino functions. > 3 > Reactive red 120 dye > 4,4'-{1,4-phenylenebis[imino(6-chloro-1,3,5-triazine-4,2-diyl)imino]}bis{5-hydroxy-6-[(2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid} > C44H30Cl2N14O20S6 > 1338.08700 > 1335.94621 > 0 > Oc1c(N=Nc2ccccc2S(O)(=O)=O)c(cc2cc(cc(Nc3nc(Cl)nc(Nc4ccc(Nc5nc(Cl)nc(Nc6cc(cc7cc(c(N=Nc8ccccc8S(O)(=O)=O)c(O)c67)S(O)(=O)=O)S(O)(=O)=O)n5)cc4)n3)c12)S(O)(=O)=O)S(O)(=O)=O > InChI=1S/C44H30Cl2N14O20S6/c45-39-51-41(55-43(53-39)49-27-17-23(81(63,64)65)13-19-15-31(85(75,76)77)35(37(61)33(19)27)59-57-25-5-1-3-7-29(25)83(69,70)71)47-21-9-11-22(12-10-21)48-42-52-40(46)54-44(56-42)50-28-18-24(82(66,67)68)14-20-16-32(86(78,79)80)36(38(62)34(20)28)60-58-26-6-2-4-8-30(26)84(72,73)74/h1-18,61-62H,(H,63,64,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H,78,79,80)(H2,47,49,51,53,55)(H2,48,50,52,54,56) > OVSNDJXCFPSPDZ-UHFFFAOYSA-N > 61951-82-4 > 8185383 > 61951-82-4 > 11469862 $$$$