1-[(3R,4S)-4-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-3-(2-methylphenyl)piperidin-1-yl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 1-[(3R,4S)-4-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-3-(2-methylphenyl)piperidin-1-yl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-benzylpiperazin-1-yl)-1-[(3R,4S)-4-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-3-(o-tolyl)-1-piperidyl]ethanone CAS Name: 1-[(3R,4S)-4-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-3-(2-methylphenyl)-1-piperidinyl]-2-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-benzylpiperazin-1-yl)-1-[(3R,4S)-4-[[3,5-bis(trifluoromethyl)phenyl]methoxy]-3-(2-methylphenyl)piperidin-1-yl]ethanone Traditional Name: 2-(4-benzylpiperazino)-1-[(3R,4S)-4-[3,5-bis(trifluoromethyl)benzyl]oxy-3-(o-tolyl)piperidino]ethanone Formula: C34H37F6N3O2 MolecularWeight: 633.666899

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CN(CCC2OCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)CN4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1[C@@H]2CN(CC[C@@H]2OCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)CN4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C34H37F6N3O2/c1-24-7-5-6-10-29(24)30-21-43(32(44)22-42-15-13-41(14-16-42)20-25-8-3-2-4-9-25)12-11-31(30)45-23-26-17-27(33(35,36)37)19-28(18-26)34(38,39)40/h2-10,17-19,30-31H,11-16,20-23H2,1H3/t30-,31-/m0/s1