(3Z)-7-benzamido-3-[[2-methyl-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (3Z)-7-benzamido-3-[[2-methyl-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3Z)-7-benzamido-3-[[2-methyl-4-(4-sulfophenyl)azo-phenyl]hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3Z)-7-benzamido-3-[[2-methyl-4-(4-sulfophenyl)azophenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3Z)-7-benzamido-3-[[2-methyl-4-[(4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3Z)-7-benzamido-4-keto-3-[[2-methyl-4-(4-sulfophenyl)azo-phenyl]hydrazono]naphthalene-2-sulfonic acid Formula: C30H23N5O8S2 MolecularWeight: 645.66232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)NN=C3C(=CC4=C(C3=O)C=CC(=C4)NC(=O)C5=CC=CC=C5)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)N/N=C/3\C(=CC4=C(C3=O)C=CC(=C4)NC(=O)C5=CC=CC=C5)S(=O)(=O)O

InChI

InChI=1S/C30H23N5O8S2/c1-18-15-23(33-32-21-7-11-24(12-8-21)44(38,39)40)10-14-26(18)34-35-28-27(45(41,42)43)17-20-16-22(9-13-25(20)29(28)36)31-30(37)19-5-3-2-4-6-19/h2-17,34H,1H3,(H,31,37)(H,38,39,40)(H,41,42,43)/b33-32?,35-28+