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

Systemtic Name: (3Z)-7-benzamido-3-[[3-methyl-4-[(2-methyl-4-sulfo-phenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3Z)-7-benzamido-3-[[3-methyl-4-(2-methyl-4-sulfo-phenyl)azo-phenyl]hydrazono]-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3Z)-7-benzamido-3-[[3-methyl-4-(2-methyl-4-sulfophenyl)azophenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3Z)-7-benzamido-3-[[3-methyl-4-[(2-methyl-4-sulfophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3Z)-7-benzamido-4-keto-3-[[3-methyl-4-(2-methyl-4-sulfo-phenyl)azo-phenyl]hydrazono]naphthalene-2-sulfonic acid Formula: C31H25N5O8S2 MolecularWeight: 659.6889

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H25N5O8S2/c1-18-14-23(9-12-26(18)34-35-27-13-10-24(15-19(27)2)45(39,40)41)33-36-29-28(46(42,43)44)17-21-16-22(8-11-25(21)30(29)37)32-31(38)20-6-4-3-5-7-20/h3-17,33H,1-2H3,(H,32,38)(H,39,40,41)(H,42,43,44)/b35-34?,36-29+