ethyl 1-(1H-benzimidazol-2-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-(1H-benzimidazol-2-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(1H-benzimidazol-2-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate CAS Name: 1-(1H-benzimidazol-2-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1H-benzimidazol-2-ylmethyl)-4-[[2-(trifluoromethyl)phenyl]methyl]piperidine-4-carboxylate Traditional Name: 1-(1H-benzimidazol-2-ylmethyl)-4-[2-(trifluoromethyl)benzyl]isonipecotic acid ethyl ester Formula: C24H26F3N3O2 MolecularWeight: 445.47735

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC2=NC3=CC=CC=C3N2)CC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC2=NC3=CC=CC=C3N2)CC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C24H26F3N3O2/c1-2-32-22(31)23(15-17-7-3-4-8-18(17)24(25,26)27)11-13-30(14-12-23)16-21-28-19-9-5-6-10-20(19)29-21/h3-10H,2,11-16H2,1H3,(H,28,29)