2-[(2E)-2-(7-azanyl-3-oxidanylidene-1-sulfo-naphthalen-2-ylidene)hydrazinyl]benzoic acid

Systemtic Name: 2-[(2E)-2-(7-azanyl-3-oxidanylidene-1-sulfo-naphthalen-2-ylidene)hydrazinyl]benzoic acid Openeye Name: 2-[(2E)-2-(7-amino-3-oxo-1-sulfo-2-naphthylidene)hydrazino]benzoic acid CAS Name: 2-[(2E)-2-(7-amino-3-oxo-1-sulfo-2-naphthalenylidene)hydrazinyl]benzoic acid IUPAC Name: 2-[(2E)-2-(7-amino-3-oxo-1-sulfonaphthalen-2-ylidene)hydrazinyl]benzoic acid Traditional Name: 2-[(N'E)-N'-(7-amino-3-keto-1-sulfo-2-naphthylidene)hydrazino]benzoic acid Formula: C17H13N3O6S MolecularWeight: 387.36662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NN=C2C(=O)C=C3C=CC(=CC3=C2S(=O)(=O)O)N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)N/N=C/2\C(=O)C=C3C=CC(=CC3=C2S(=O)(=O)O)N

InChI

InChI=1S/C17H13N3O6S/c18-10-6-5-9-7-14(21)15(16(12(9)8-10)27(24,25)26)20-19-13-4-2-1-3-11(13)17(22)23/h1-8,19H,18H2,(H,22,23)(H,24,25,26)/b20-15+