ethyl 1-(2-methoxypyridin-3-yl)carbonyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-methoxypyridin-3-yl)carbonyl-4-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(2-methoxypyridine-3-carbonyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate CAS Name: 1-[(2-methoxy-3-pyridinyl)-oxomethyl]-4-[[3-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methoxypyridine-3-carbonyl)-4-[[3-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Traditional Name: 1-(2-methoxynicotinoyl)-4-[3-(trifluoromethyl)benzyl]isonipecotic acid ethyl ester Formula: C23H25F3N2O4 MolecularWeight: 450.45081

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=C(N=CC=C2)OC)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=C(N=CC=C2)OC)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C23H25F3N2O4/c1-3-32-21(30)22(15-16-6-4-7-17(14-16)23(24,25)26)9-12-28(13-10-22)20(29)18-8-5-11-27-19(18)31-2/h4-8,11,14H,3,9-10,12-13,15H2,1-2H3