(5E)-6-oxidanylidene-5-[[4-[(4-phenylazanyl-3-sulfo-phenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]naphthalene-2-sulfonic acid

Systemtic Name: (5E)-6-oxidanylidene-5-[[4-[(4-phenylazanyl-3-sulfo-phenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]naphthalene-2-sulfonic acid Openeye Name: (5E)-5-[[4-(4-anilino-3-sulfo-phenyl)azo-1-naphthyl]hydrazono]-6-oxo-naphthalene-2-sulfonic acid CAS Name: (5E)-5-[[4-(4-anilino-3-sulfophenyl)azo-1-naphthalenyl]hydrazinylidene]-6-oxo-2-naphthalenesulfonic acid IUPAC Name: (5E)-5-[[4-[(4-anilino-3-sulfophenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]-6-oxonaphthalene-2-sulfonic acid Traditional Name: (5E)-5-[[4-(4-anilino-3-sulfo-phenyl)azo-1-naphthyl]hydrazono]-6-keto-naphthalene-2-sulfonic acid Formula: C32H23N5O7S2 MolecularWeight: 653.68432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C=C(C=C2)N=NC3=CC=C(C4=CC=CC=C43)NN=C5C6=C(C=CC5=O)C=C(C=C6)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C=C(C=C2)N=NC3=CC=C(C4=CC=CC=C43)N/N=C/5\C6=C(C=CC5=O)C=C(C=C6)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C32H23N5O7S2/c38-30-17-10-20-18-23(45(39,40)41)12-13-24(20)32(30)37-36-28-16-15-27(25-8-4-5-9-26(25)28)35-34-22-11-14-29(31(19-22)46(42,43)44)33-21-6-2-1-3-7-21/h1-19,33,36H,(H,39,40,41)(H,42,43,44)/b35-34?,37-32+