(3S,4S)-N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-1-(1-ethanoylpiperidin-4-yl)-3-(4-fluoranyl-2-methyl-phenyl)-N-methyl-piperidine-4-carboxamide

Systemtic Name: (3S,4S)-N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-1-(1-ethanoylpiperidin-4-yl)-3-(4-fluoranyl-2-methyl-phenyl)-N-methyl-piperidine-4-carboxamide Openeye Name: (3S,4S)-1-(1-acetyl-4-piperidyl)-N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-(4-fluoro-2-methyl-phenyl)-N-methyl-piperidine-4-carboxamide CAS Name: (3S,4S)-1-(1-acetyl-4-piperidinyl)-N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-(4-fluoro-2-methylphenyl)-N-methyl-4-piperidinecarboxamide IUPAC Name: (3S,4S)-1-(1-acetylpiperidin-4-yl)-N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-(4-fluoro-2-methylphenyl)-N-methylpiperidine-4-carboxamide Traditional Name: (3S,4S)-1-(1-acetyl-4-piperidyl)-N-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-3-(4-fluoro-2-methyl-phenyl)-N-methyl-isonipecotamide Formula: C31H36F7N3O2 MolecularWeight: 615.625262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2CN(CCC2C(=O)N(C)C(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)F)[C@H]2CN(CC[C@@H]2C(=O)N(C)[C@@H](C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4CCN(CC4)C(=O)C

InChI

InChI=1S/C31H36F7N3O2/c1-18-13-24(32)5-6-26(18)28-17-41(25-7-10-40(11-8-25)20(3)42)12-9-27(28)29(43)39(4)19(2)21-14-22(30(33,34)35)16-23(15-21)31(36,37)38/h5-6,13-16,19,25,27-28H,7-12,17H2,1-4H3/t19-,27-,28+/m0/s1