methyl 2,6-dimethyl-5-oxidanyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 2,6-dimethyl-5-oxidanyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-hydroxy-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate CAS Name: 5-hydroxy-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-hydroxy-2,6-dimethyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C16H16F3NO3 MolecularWeight: 327.29835

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)O)C2=CC=CC=C2C(F)(F)F)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)O)C2=CC=CC=C2C(F)(F)F)C(=O)OC

InChI

InChI=1S/C16H16F3NO3/c1-8-12(15(22)23-3)13(14(21)9(2)20-8)10-6-4-5-7-11(10)16(17,18)19/h4-7,13,20-21H,1-3H3