2-ethyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2-ethyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2-ethyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2-ethyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2-ethyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2-ethyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C17H16F3NO4 MolecularWeight: 355.30845

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=C(N1)C)C(=O)O)C2=CC=CC=C2C(F)(F)F)C(=O)O

Isomeric SMILES

CCC1=C(C(C(=C(N1)C)C(=O)O)C2=CC=CC=C2C(F)(F)F)C(=O)O

InChI

InChI=1S/C17H16F3NO4/c1-3-11-14(16(24)25)13(12(15(22)23)8(2)21-11)9-6-4-5-7-10(9)17(18,19)20/h4-7,13,21H,3H2,1-2H3,(H,22,23)(H,24,25)