1-[4-[4-[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-2-(phenylmethyl)piperidin-4-yl]piperazin-1-yl]piperidin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone

Systemtic Name: 1-[4-[4-[1-[3,5-bis(trifluoromethyl)phenyl]carbonyl-2-(phenylmethyl)piperidin-4-yl]piperazin-1-yl]piperidin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Openeye Name: 1-[4-[4-[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]-4-piperidyl]piperazin-1-yl]-1-piperidyl]-2-(3,4,5-trimethoxyphenyl)ethanone CAS Name: 1-[4-[4-[1-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-2-(phenylmethyl)-4-piperidinyl]-1-piperazinyl]-1-piperidinyl]-2-(3,4,5-trimethoxyphenyl)ethanone IUPAC Name: 1-[4-[4-[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]piperidin-4-yl]piperazin-1-yl]piperidin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Traditional Name: 1-[4-[4-[2-benzyl-1-[3,5-bis(trifluoromethyl)benzoyl]-4-piperidyl]piperazino]piperidino]-2-(3,4,5-trimethoxyphenyl)ethanone Formula: C41H48F6N4O5 MolecularWeight: 790.834039

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC(=O)N2CCC(CC2)N3CCN(CC3)C4CCN(C(C4)CC5=CC=CC=C5)C(=O)C6=CC(=CC(=C6)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC(=O)N2CCC(CC2)N3CCN(CC3)C4CCN(C(C4)CC5=CC=CC=C5)C(=O)C6=CC(=CC(=C6)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C41H48F6N4O5/c1-54-35-20-28(21-36(55-2)38(35)56-3)22-37(52)50-12-9-32(10-13-50)48-15-17-49(18-16-48)33-11-14-51(34(26-33)19-27-7-5-4-6-8-27)39(53)29-23-30(40(42,43)44)25-31(24-29)41(45,46)47/h4-8,20-21,23-25,32-34H,9-19,22,26H2,1-3H3