[2-[(4-chlorophenyl)methyl]-4-[2-[2-(methoxymethyl)morpholin-4-yl]ethyl]piperazin-1-yl]-[3-pyridin-4-yl-5-(trifluoromethyl)phenyl]methanone trihydrochloride

Systemtic Name: [2-[(4-chlorophenyl)methyl]-4-[2-[2-(methoxymethyl)morpholin-4-yl]ethyl]piperazin-1-yl]-[3-pyridin-4-yl-5-(trifluoromethyl)phenyl]methanone trihydrochloride Openeye Name: [2-[(4-chlorophenyl)methyl]-4-[2-[2-(methoxymethyl)morpholin-4-yl]ethyl]piperazin-1-yl]-[3-(4-pyridyl)-5-(trifluoromethyl)phenyl]methanone trihydrochloride CAS Name: [2-[(4-chlorophenyl)methyl]-4-[2-[2-(methoxymethyl)-4-morpholinyl]ethyl]-1-piperazinyl]-[3-pyridin-4-yl-5-(trifluoromethyl)phenyl]methanone trihydrochloride IUPAC Name: [2-[(4-chlorophenyl)methyl]-4-[2-[2-(methoxymethyl)morpholin-4-yl]ethyl]piperazin-1-yl]-[3-pyridin-4-yl-5-(trifluoromethyl)phenyl]methanone trihydrochloride Traditional Name: [2-(4-chlorobenzyl)-4-[2-[2-(methoxymethyl)morpholino]ethyl]piperazino]-[3-(4-pyridyl)-5-(trifluoromethyl)phenyl]methanone trihydrochloride Formula: C32H39Cl4F3N4O3 MolecularWeight: 726.48427

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CN(CCO1)CCN2CCN(C(C2)CC3=CC=C(C=C3)Cl)C(=O)C4=CC(=CC(=C4)C5=CC=NC=C5)C(F)(F)F.Cl.Cl.Cl

Isomeric SMILES

COCC1CN(CCO1)CCN2CCN(C(C2)CC3=CC=C(C=C3)Cl)C(=O)C4=CC(=CC(=C4)C5=CC=NC=C5)C(F)(F)F.Cl.Cl.Cl

InChI

InChI=1S/C32H36ClF3N4O3.3ClH/c1-42-22-30-21-39(14-15-43-30)11-10-38-12-13-40(29(20-38)16-23-2-4-28(33)5-3-23)31(41)26-17-25(24-6-8-37-9-7-24)18-27(19-26)32(34,35)36;;;/h2-9,17-19,29-30H,10-16,20-22H2,1H3;3*1H