methyl 2-[[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]benzoate

Systemtic Name: methyl 2-[[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]benzoate Openeye Name: methyl 2-[[2-oxo-5-(trifluoromethyl)-1-pyridyl]methyl]benzoate CAS Name: 2-[[2-oxo-5-(trifluoromethyl)-1-pyridinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-oxo-5-(trifluoromethyl)pyridin-1-yl]methyl]benzoate Traditional Name: 2-[[2-keto-5-(trifluoromethyl)-1-pyridyl]methyl]benzoic acid methyl ester Formula: C15H12F3NO3 MolecularWeight: 311.25589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1CN2C=C(C=CC2=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1CN2C=C(C=CC2=O)C(F)(F)F

InChI

InChI=1S/C15H12F3NO3/c1-22-14(21)12-5-3-2-4-10(12)8-19-9-11(15(16,17)18)6-7-13(19)20/h2-7,9H,8H2,1H3