[4-[2-[4,4-bis(fluoranyl)piperidin-1-yl]ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-[2-[4,4-bis(fluoranyl)piperidin-1-yl]ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Openeye Name: [4-[2-(4,4-difluoro-1-piperidyl)ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone CAS Name: [4-[2-(4,4-difluoro-1-piperidinyl)ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-[2-(4,4-difluoropiperidin-1-yl)ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Traditional Name: [4-[2-(4,4-difluoropiperidino)ethyl]-2-[4-(trifluoromethyl)benzyl]piperazino]-[3-methoxy-5-(trifluoromethyl)phenyl]methanone Formula: C28H31F8N3O2 MolecularWeight: 593.551866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(F)(F)F)C(=O)N2CCN(CC2CC3=CC=C(C=C3)C(F)(F)F)CCN4CCC(CC4)(F)F

Isomeric SMILES

COC1=CC(=CC(=C1)C(F)(F)F)C(=O)N2CCN(CC2CC3=CC=C(C=C3)C(F)(F)F)CCN4CCC(CC4)(F)F

InChI

InChI=1S/C28H31F8N3O2/c1-41-24-16-20(15-22(17-24)28(34,35)36)25(40)39-13-12-38(11-10-37-8-6-26(29,30)7-9-37)18-23(39)14-19-2-4-21(5-3-19)27(31,32)33/h2-5,15-17,23H,6-14,18H2,1H3