null
  CDK     0225161909
null
 32 35  0  0  0  0  0  0  0  0999 V2000
   -7.1132    2.1880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7776    1.4343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9572    1.3481    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4722    2.0155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6518    1.9293    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6216    0.5944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1065   -0.0730    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8011    0.5082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4656   -0.2455    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6586   -0.4170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3260   -1.5731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5810   -2.3577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3879   -2.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9400   -1.9161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6850   -1.1315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8781   -0.9600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -1.6500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  3  6  1  0  0  0  0 
  6  7  2  0  0  0  0 
  6  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10 11  2  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 12  1  0  0  0  0 
 17  9  1  0  0  0  0 
 11 18  1  0  0  0  0 
 18 19  2  0  0  0  0 
 18 20  1  0  0  0  0 
 20 21  2  0  0  0  0 
 20 22  1  0  0  0  0 
 22 23  1  0  0  0  0 
 23 24  2  0  0  0  0 
 24 25  1  0  0  0  0 
 25 26  2  0  0  0  0 
 26 27  1  0  0  0  0 
 27 28  2  0  0  0  0 
 28 23  1  0  0  0  0 
 26 29  1  0  0  0  0 
 29 30  1  0  0  0  0 
 30 31  1  0  0  0  0 
 31 32  1  0  0  0  0 
 32 25  1  0  0  0  0 
M  END
> <ID>
CHEBI:121148

> <NAME>
2-[1-[2-(diethylamino)-2-oxoethyl]-3-indolyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoacetamide

> <STAR>
2

> <FORMULA>
C24H25N3O5

> <MASS>
435.473

> <MONOISOTOPIC_MASS>
435.17942

> <CHARGE>
0

> <SMILES>
CCN(CC)C(=O)CN1C=C(C2=CC=CC=C21)C(=O)C(=O)NC3=CC4=C(C=C3)OCCO4

> <INCHI>
InChI=1S/C24H25N3O5/c1-3-26(4-2)22(28)15-27-14-18(17-7-5-6-8-19(17)27)23(29)24(30)25-16-9-10-20-21(13-16)32-12-11-31-20/h5-10,13-14H,3-4,11-12,15H2,1-2H3,(H,25,30)

> <INCHIKEY>
ABBTYIZLBREAAO-UHFFFAOYSA-N

> <LINCS_ACCESSION>
LSM-32591

$$$$