5-[(4-nitrophenyl)hydrazinylidene]-6-oxidanylidene-3-[(4-sulfophenyl)diazenyl]cyclohexa-1,3-diene-1-carboxylic acid; sodium

Systemtic Name: 5-[(4-nitrophenyl)hydrazinylidene]-6-oxidanylidene-3-[(4-sulfophenyl)diazenyl]cyclohexa-1,3-diene-1-carboxylic acid; sodium Openeye Name: 5-[(4-nitrophenyl)hydrazono]-6-oxo-3-(4-sulfophenyl)azo-cyclohexa-1,3-diene-1-carboxylic acid; sodium CAS Name: 5-[(4-nitrophenyl)hydrazinylidene]-6-oxo-3-(4-sulfophenyl)azo-1-cyclohexa-1,3-dienecarboxylic acid; sodium IUPAC Name: 5-[(4-nitrophenyl)hydrazinylidene]-6-oxo-3-[(4-sulfophenyl)diazenyl]cyclohexa-1,3-diene-1-carboxylic acid; sodium Traditional Name: 6-keto-5-[(4-nitrophenyl)hydrazono]-3-(4-sulfophenyl)azo-cyclohexa-1,3-diene-1-carboxylic acid; sodium Formula: C19H13N5NaO8S MolecularWeight: 494.38999

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C=C(C=C(C2=O)C(=O)O)N=NC3=CC=C(C=C3)S(=O)(=O)O)[N+](=O)[O-].[Na]

Isomeric SMILES

C1=CC(=CC=C1NN=C2C=C(C=C(C2=O)C(=O)O)N=NC3=CC=C(C=C3)S(=O)(=O)O)[N+](=O)[O-].[Na]

InChI

InChI=1S/C19H13N5O8S.Na/c25-18-16(19(26)27)9-13(22-20-12-3-7-15(8-4-12)33(30,31)32)10-17(18)23-21-11-1-5-14(6-2-11)24(28)29;/h1-10,21H,(H,26,27)(H,30,31,32);