4-[(E)-2-cyano-3-[(4-hydroxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(E)-2-cyano-3-[(4-hydroxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(E)-2-cyano-3-(4-hydroxyanilino)-3-oxo-prop-1-enyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(E)-2-cyano-3-(4-hydroxyanilino)-3-oxoprop-1-enyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(E)-2-cyano-3-(4-hydroxyanilino)-3-oxoprop-1-enyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(E)-2-cyano-3-(4-hydroxyanilino)-3-keto-prop-1-enyl]-2-methoxy-6-nitro-phenolate Formula: C17H12N3O6- MolecularWeight: 354.29368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C(C#N)C(=O)NC2=CC=C(C=C2)O

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)O

InChI

InChI=1S/C17H13N3O6/c1-26-15-8-10(7-14(16(15)22)20(24)25)6-11(9-18)17(23)19-12-2-4-13(21)5-3-12/h2-8,21-22H,1H3,(H,19,23)/p-1/b11-6+