ethyl 1-(cyclopenten-1-ylcarbonyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-(cyclopenten-1-ylcarbonyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(cyclopentene-1-carbonyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate CAS Name: 1-[1-cyclopentenyl(oxo)methyl]-4-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(cyclopentene-1-carbonyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Traditional Name: 1-(cyclopentene-1-carbonyl)-4-[2-(trifluoromethyl)benzyl]isonipecotic acid ethyl ester Formula: C22H26F3NO3 MolecularWeight: 409.44195

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=CCCC2)CC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=CCCC2)CC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C22H26F3NO3/c1-2-29-20(28)21(15-17-9-5-6-10-18(17)22(23,24)25)11-13-26(14-12-21)19(27)16-7-3-4-8-16/h5-7,9-10H,2-4,8,11-15H2,1H3