[4-(trifluoromethyl)phenyl]methyl 5-cyano-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: [4-(trifluoromethyl)phenyl]methyl 5-cyano-2-methyl-6-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: [4-(trifluoromethyl)phenyl]methyl 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylic acid [4-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [4-(trifluoromethyl)phenyl]methyl 5-cyano-2-methyl-6-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-6-keto-2-methyl-1H-pyridine-3-carboxylic acid [4-(trifluoromethyl)benzyl] ester Formula: C16H11F3N2O3 MolecularWeight: 336.26535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=O)N1)C#N)C(=O)OCC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C(=O)N1)C#N)C(=O)OCC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H11F3N2O3/c1-9-13(6-11(7-20)14(22)21-9)15(23)24-8-10-2-4-12(5-3-10)16(17,18)19/h2-6H,8H2,1H3,(H,21,22)