(3Z)-3-[[3-methyl-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-6-phenylazanyl-naphthalene-2-sulfonic acid

Systemtic Name: (3Z)-3-[[3-methyl-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-6-phenylazanyl-naphthalene-2-sulfonic acid Openeye Name: (3Z)-6-anilino-3-[[3-methyl-4-(4-sulfophenyl)azo-phenyl]hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3Z)-6-anilino-3-[[3-methyl-4-(4-sulfophenyl)azophenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3Z)-6-anilino-3-[[3-methyl-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3Z)-6-anilino-4-keto-3-[[3-methyl-4-(4-sulfophenyl)azo-phenyl]hydrazono]naphthalene-2-sulfonic acid Formula: C29H23N5O7S2 MolecularWeight: 617.65222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NN=C2C(=CC3=C(C2=O)C=C(C=C3)NC4=CC=CC=C4)S(=O)(=O)O)N=NC5=CC=C(C=C5)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)N/N=C/2\C(=CC3=C(C2=O)C=C(C=C3)NC4=CC=CC=C4)S(=O)(=O)O)N=NC5=CC=C(C=C5)S(=O)(=O)O

InChI

InChI=1S/C29H23N5O7S2/c1-18-15-23(11-14-26(18)33-31-21-9-12-24(13-10-21)42(36,37)38)32-34-28-27(43(39,40)41)16-19-7-8-22(17-25(19)29(28)35)30-20-5-3-2-4-6-20/h2-17,30,32H,1H3,(H,36,37,38)(H,39,40,41)/b33-31?,34-28+