ethyl 2-oxidanylidene-1-(phenylmethyl)-6-propyl-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-1-(phenylmethyl)-6-propyl-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylate Openeye Name: ethyl 1-benzyl-2-oxo-6-propyl-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylate CAS Name: 2-oxo-1-(phenylmethyl)-6-propyl-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-2-oxo-6-propyl-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylate Traditional Name: 1-benzyl-2-keto-6-propyl-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-5-carboxylic acid ethyl ester Formula: C25H26F3NO3 MolecularWeight: 445.47405

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(CC(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(CC(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C25H26F3NO3/c1-3-10-21-23(24(31)32-4-2)19(18-13-8-9-14-20(18)25(26,27)28)15-22(30)29(21)16-17-11-6-5-7-12-17/h5-9,11-14,19H,3-4,10,15-16H2,1-2H3