ethyl 1-(1-ethanoylpiperidin-4-yl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-(1-ethanoylpiperidin-4-yl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(1-acetyl-4-piperidyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate CAS Name: 1-(1-acetyl-4-piperidinyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-acetylpiperidin-4-yl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Traditional Name: 1-(1-acetyl-4-piperidyl)-4-[2-(trifluoromethyl)benzyl]isonipecotic acid ethyl ester Formula: C23H31F3N2O3 MolecularWeight: 440.49905

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C2CCN(CC2)C(=O)C)CC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C2CCN(CC2)C(=O)C)CC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C23H31F3N2O3/c1-3-31-21(30)22(16-18-6-4-5-7-20(18)23(24,25)26)10-14-28(15-11-22)19-8-12-27(13-9-19)17(2)29/h4-7,19H,3,8-16H2,1-2H3