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

Systemtic Name: ethyl 1-(1-methoxypropan-2-yl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(2-methoxy-1-methyl-ethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate CAS Name: 1-(1-methoxypropan-2-yl)-4-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-methoxypropan-2-yl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Traditional Name: 1-(2-methoxy-1-methyl-ethyl)-4-[2-(trifluoromethyl)benzyl]isonipecotic acid ethyl ester Formula: C20H28F3NO3 MolecularWeight: 387.43643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(C)COC)CC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(C)COC)CC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C20H28F3NO3/c1-4-27-18(25)19(9-11-24(12-10-19)15(2)14-26-3)13-16-7-5-6-8-17(16)20(21,22)23/h5-8,15H,4,9-14H2,1-3H3