3-cyano-1-ethanoyl-2-oxidanylidene-6-(4-phenylphenyl)pyridine-4-carboxylic acid

Systemtic Name: 3-cyano-1-ethanoyl-2-oxidanylidene-6-(4-phenylphenyl)pyridine-4-carboxylic acid Openeye Name: 1-acetyl-3-cyano-2-oxo-6-(4-phenylphenyl)pyridine-4-carboxylic acid CAS Name: 1-acetyl-3-cyano-2-oxo-6-(4-phenylphenyl)-4-pyridinecarboxylic acid IUPAC Name: 1-acetyl-3-cyano-2-oxo-6-(4-phenylphenyl)pyridine-4-carboxylic acid Traditional Name: 1-acetyl-3-cyano-2-keto-6-(4-phenylphenyl)isonicotinic acid Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=CC(=C(C1=O)C#N)C(=O)O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N1C(=CC(=C(C1=O)C#N)C(=O)O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H14N2O4/c1-13(24)23-19(11-17(21(26)27)18(12-22)20(23)25)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-11H,1H3,(H,26,27)