(6E)-4-azanyl-3-[(5-azanyl-2-sulfo-phenyl)diazenyl]-7-methyl-6-[(4-methylphenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (6E)-4-azanyl-3-[(5-azanyl-2-sulfo-phenyl)diazenyl]-7-methyl-6-[(4-methylphenyl)hydrazinylidene]-5-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (6E)-4-amino-3-(5-amino-2-sulfo-phenyl)azo-7-methyl-5-oxo-6-(p-tolylhydrazono)naphthalene-2-sulfonic acid CAS Name: (6E)-4-amino-3-(5-amino-2-sulfophenyl)azo-7-methyl-6-[(4-methylphenyl)hydrazinylidene]-5-oxo-2-naphthalenesulfonic acid IUPAC Name: (6E)-4-amino-3-[(5-amino-2-sulfophenyl)diazenyl]-7-methyl-6-[(4-methylphenyl)hydrazinylidene]-5-oxonaphthalene-2-sulfonic acid Traditional Name: (6E)-4-amino-3-(5-amino-2-sulfo-phenyl)azo-5-keto-7-methyl-6-(p-tolylhydrazono)naphthalene-2-sulfonic acid Formula: C24H22N6O7S2 MolecularWeight: 570.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=C(C=CC(=C4)N)S(=O)(=O)O)S(=O)(=O)O)C

Isomeric SMILES

CC1=CC=C(C=C1)N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=C(C=CC(=C4)N)S(=O)(=O)O)S(=O)(=O)O)C

InChI

InChI=1S/C24H22N6O7S2/c1-12-3-6-16(7-4-12)27-29-22-13(2)9-14-10-19(39(35,36)37)23(21(26)20(14)24(22)31)30-28-17-11-15(25)5-8-18(17)38(32,33)34/h3-11,27H,25-26H2,1-2H3,(H,32,33,34)(H,35,36,37)/b29-22+,30-28?