(3-cyano-4-phenyl-phenyl)methyl 5-methyl-6-oxidanyl-4-oxidanylidene-2-propyl-1H-pyridine-3-carboxylate

Systemtic Name: (3-cyano-4-phenyl-phenyl)methyl 5-methyl-6-oxidanyl-4-oxidanylidene-2-propyl-1H-pyridine-3-carboxylate Openeye Name: (3-cyano-4-phenyl-phenyl)methyl 6-hydroxy-5-methyl-4-oxo-2-propyl-1H-pyridine-3-carboxylate CAS Name: 6-hydroxy-5-methyl-4-oxo-2-propyl-1H-pyridine-3-carboxylic acid (3-cyano-4-phenylphenyl)methyl ester IUPAC Name: (3-cyano-4-phenylphenyl)methyl 6-hydroxy-5-methyl-4-oxo-2-propyl-1H-pyridine-3-carboxylate Traditional Name: 6-hydroxy-4-keto-5-methyl-2-propyl-1H-pyridine-3-carboxylic acid (3-cyano-4-phenyl-benzyl) ester Formula: C24H22N2O4 MolecularWeight: 402.44248

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)C(=C(N1)O)C)C(=O)OCC2=CC(=C(C=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCC1=C(C(=O)C(=C(N1)O)C)C(=O)OCC2=CC(=C(C=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C24H22N2O4/c1-3-7-20-21(22(27)15(2)23(28)26-20)24(29)30-14-16-10-11-19(18(12-16)13-25)17-8-5-4-6-9-17/h4-6,8-12H,3,7,14H2,1-2H3,(H2,26,27,28)