[3,5-bis(trifluoromethyl)phenyl]-[4-[2-[2-(methoxymethyl)-5-methyl-morpholin-4-yl]ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone dihydrochloride

Systemtic Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[2-[2-(methoxymethyl)-5-methyl-morpholin-4-yl]ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone dihydrochloride Openeye Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[2-[2-(methoxymethyl)-5-methyl-morpholin-4-yl]ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone dihydrochloride CAS Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[2-[2-(methoxymethyl)-5-methyl-4-morpholinyl]ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]methanone dihydrochloride IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[2-[2-(methoxymethyl)-5-methylmorpholin-4-yl]ethyl]-2-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone dihydrochloride Traditional Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[2-[2-(methoxymethyl)-5-methyl-morpholino]ethyl]-2-[4-(trifluoromethyl)benzyl]piperazino]methanone dihydrochloride Formula: C30H36Cl2F9N3O3 MolecularWeight: 728.516769

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC(CN1CCN2CCN(C(C2)CC3=CC=C(C=C3)C(F)(F)F)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)COC.Cl.Cl

Isomeric SMILES

CC1COC(CN1CCN2CCN(C(C2)CC3=CC=C(C=C3)C(F)(F)F)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)COC.Cl.Cl

InChI

InChI=1S/C30H34F9N3O3.2ClH/c1-19-17-45-26(18-44-2)16-41(19)9-7-40-8-10-42(25(15-40)11-20-3-5-22(6-4-20)28(31,32)33)27(43)21-12-23(29(34,35)36)14-24(13-21)30(37,38)39;;/h3-6,12-14,19,25-26H,7-11,15-18H2,1-2H3;2*1H