2-[2-(2-azanylidene-8-oxidanylidene-6-sulfo-naphthalen-1-yl)hydrazinyl]-5-nitro-benzoic acid

Systemtic Name: 2-[2-(2-azanylidene-8-oxidanylidene-6-sulfo-naphthalen-1-yl)hydrazinyl]-5-nitro-benzoic acid Openeye Name: 2-[2-(2-imino-8-oxo-6-sulfo-1-naphthyl)hydrazino]-5-nitro-benzoic acid CAS Name: 2-[(2-imino-8-oxo-6-sulfo-1-naphthalenyl)hydrazo]-5-nitrobenzoic acid IUPAC Name: 2-[2-(2-imino-8-oxo-6-sulfonaphthalen-1-yl)hydrazinyl]-5-nitrobenzoic acid Traditional Name: 2-[N'-(2-imino-8-keto-6-sulfo-1-naphthyl)hydrazino]-5-nitro-benzoic acid Formula: C17H12N4O8S MolecularWeight: 432.36418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)O)NNC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=N)C(=C2C1=CC(=CC2=O)S(=O)(=O)O)NNC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H12N4O8S/c18-12-3-1-8-5-10(30(27,28)29)7-14(22)15(8)16(12)20-19-13-4-2-9(21(25)26)6-11(13)17(23)24/h1-7,18-20H,(H,23,24)(H,27,28,29)