ethyl 1-(cyclohex-3-en-1-ylmethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-(cyclohex-3-en-1-ylmethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(cyclohex-3-en-1-ylmethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate CAS Name: 1-(1-cyclohex-3-enylmethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(cyclohex-3-en-1-ylmethyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-4-[3-(trifluoromethyl)benzyl]isonipecotic acid ethyl ester Formula: C23H30F3NO2 MolecularWeight: 409.48501

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2CCC=CC2)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2CCC=CC2)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C23H30F3NO2/c1-2-29-21(28)22(16-19-9-6-10-20(15-19)23(24,25)26)11-13-27(14-12-22)17-18-7-4-3-5-8-18/h3-4,6,9-10,15,18H,2,5,7-8,11-14,16-17H2,1H3