methyl 5-cyano-4-[4-fluoranyl-6-methyl-6-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-4-[4-fluoranyl-6-methyl-6-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-cyano-4-[4-fluoro-6-methyl-6-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-[4-fluoro-6-methyl-6-(trifluoromethyl)-1-cyclohexa-1,3-dienyl]-2-methyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-[4-fluoro-6-methyl-6-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-4-[4-fluoro-6-methyl-6-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-2-methyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C17H16F4N2O2 MolecularWeight: 356.314753

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=CN1)C#N)C2=CC=C(CC2(C)C(F)(F)F)F)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=CN1)C#N)C2=CC=C(CC2(C)C(F)(F)F)F)C(=O)OC

InChI

InChI=1S/C17H16F4N2O2/c1-9-13(15(24)25-3)14(10(7-22)8-23-9)12-5-4-11(18)6-16(12,2)17(19,20)21/h4-5,8,14,23H,6H2,1-3H3