8-azanyl-7-cyano-2-(4-methoxyphenyl)-3-oxidanylidene-6-phenyl-cinnoline-4-carboxylic acid

Systemtic Name: 8-azanyl-7-cyano-2-(4-methoxyphenyl)-3-oxidanylidene-6-phenyl-cinnoline-4-carboxylic acid Openeye Name: 8-amino-7-cyano-2-(4-methoxyphenyl)-3-oxo-6-phenyl-cinnoline-4-carboxylic acid CAS Name: 8-amino-7-cyano-2-(4-methoxyphenyl)-3-oxo-6-phenyl-4-cinnolinecarboxylic acid IUPAC Name: 8-amino-7-cyano-2-(4-methoxyphenyl)-3-oxo-6-phenylcinnoline-4-carboxylic acid Traditional Name: 8-amino-7-cyano-3-keto-2-(4-methoxyphenyl)-6-phenyl-cinnoline-4-carboxylic acid Formula: C23H16N4O4 MolecularWeight: 412.39754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(=C3C=C(C(=C(C3=N2)N)C#N)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(=C3C=C(C(=C(C3=N2)N)C#N)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H16N4O4/c1-31-15-9-7-14(8-10-15)27-22(28)19(23(29)30)17-11-16(13-5-3-2-4-6-13)18(12-24)20(25)21(17)26-27/h2-11H,25H2,1H3,(H,29,30)