Ketcher 08261512582D 1   1.00000     0.00000     0

 23 25  0     0  0            999 V2000
   11.7742   -3.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7742   -4.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9081   -2.6322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9081   -4.6322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0421   -3.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0421   -4.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6403   -4.6322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6403   -5.6323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5063   -4.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2383   -3.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2383   -4.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3723   -2.6322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3723   -4.6322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5063   -3.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5063   -6.1323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5063   -7.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6403   -7.6322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7742   -6.1323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7742   -7.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6403   -8.6323    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.1043   -2.6322    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1762   -2.6322    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.1043   -4.6322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  3  1  2  0     0  0
  4  2  2  0     0  0
  5  3  1  0     0  0
  6  4  1  0     0  0
  6  5  2  0     0  0
  2  7  1  0     0  0
  7  8  2  0     0  0
  7  9  1  0     0  0
 11 10  1  0     0  0
 12 10  2  0     0  0
 13 11  2  0     0  0
 14 12  1  0     0  0
  9 13  1  0     0  0
  9 14  2  0     0  0
 16 15  2  0     0  0
 18  8  1  0     0  0
 19 17  1  0     0  0
 19 18  2  0     0  0
  8 15  1  0     0  0
 17 20  2  0     0  0
 17 16  1  0     0  0
 10 21  1  0     0  0
  5 22  1  0     0  0
 11 23  1  0     0  0
M  END
> <ID>
CHEBI:87666

> <NAME>
rosanilin free base

> <DEFINITION>
An imine that is 4-methylidenecyclohexa-2,5-dien-1-imine in which the hydrogens of the methylidene group are replaced by 4-aminophenyl and 3-methyl-4-aminophenyl groups. The monohydrochloride salt is the histological dye 'rosanilin'.

> <STAR>
3

> <SYNONYM>
Rosaniline base; Magenta base; Fuchsine Base; CI Solvent Red 41; CI Basic Violet 41, free base; CI 42510B; C.I. Solvent Red 41; C.I. Basic Violet 14, free base; 4-((4-Aminophenyl)(4-imino-2,5-cyclohexadien-1-ylidene)methyl)-2-methylbenzenamine

> <IUPAC_NAME>
4-[(4-aminophenyl)(4-iminocyclohexa-2,5-dien-1-ylidene)methyl]-2-methylaniline

> <FORMULA>
C20H19N3

> <MASS>
301.386

> <MONOISOTOPIC_MASS>
301.15790

> <CHARGE>
0

> <SMILES>
C=1C(=CC=C(C1)N)C(=C2C=CC(=N)C=C2)C=3C=C(C(=CC3)N)C

> <INCHI>
InChI=1S/C20H19N3/c1-13-12-16(6-11-19(13)23)20(14-2-7-17(21)8-3-14)15-4-9-18(22)10-5-15/h2-12,21H,22-23H2,1H3/b20-14-,21-17?

> <INCHIKEY>
WVYMEHMNEMRCEL-SFVWPUANSA-N

> <CAS_REGISTRY_NUMBER>
3248-93-9

> <REAXYS_REGISTRY_NUMBER>
2814815

> <CHEMIDPLUS>
3248-93-9

> <WIKIPEDIA_ACCESSION>
Fuchsine

$$$$