4-(4-cyanophenyl)-6-methyl-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid

Systemtic Name: 4-(4-cyanophenyl)-6-methyl-2-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid Openeye Name: 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid CAS Name: 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid IUPAC Name: 4-(4-cyanophenyl)-6-methyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid Traditional Name: 4-(4-cyanophenyl)-2-keto-6-methyl-1-[3-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid Formula: C21H15F3N2O3 MolecularWeight: 400.35061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1C2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C=C3)C#N)C(=O)O

Isomeric SMILES

CC1=C(C(CC(=O)N1C2=CC=CC(=C2)C(F)(F)F)C3=CC=C(C=C3)C#N)C(=O)O

InChI

InChI=1S/C21H15F3N2O3/c1-12-19(20(28)29)17(14-7-5-13(11-25)6-8-14)10-18(27)26(12)16-4-2-3-15(9-16)21(22,23)24/h2-9,17H,10H2,1H3,(H,28,29)