[3,5-bis(trifluoromethyl)phenyl]-[4-[(E)-4-morpholin-4-ylbut-2-enyl]-2-(naphthalen-2-ylmethyl)piperazin-1-yl]methanone dihydrochloride

Systemtic Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[(E)-4-morpholin-4-ylbut-2-enyl]-2-(naphthalen-2-ylmethyl)piperazin-1-yl]methanone dihydrochloride Openeye Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[(E)-4-morpholinobut-2-enyl]-2-(2-naphthylmethyl)piperazin-1-yl]methanone dihydrochloride CAS Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[(E)-4-(4-morpholinyl)but-2-enyl]-2-(2-naphthalenylmethyl)-1-piperazinyl]methanone dihydrochloride IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[(E)-4-morpholin-4-ylbut-2-enyl]-2-(naphthalen-2-ylmethyl)piperazin-1-yl]methanone dihydrochloride Traditional Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[(E)-4-morpholinobut-2-enyl]-2-(2-naphthylmethyl)piperazino]methanone dihydrochloride Formula: C32H35Cl2F6N3O2 MolecularWeight: 678.535619

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC=CCN2CCOCC2)CC3=CC4=CC=CC=C4C=C3)C(=O)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F.Cl.Cl

Isomeric SMILES

C1CN(C(CN1C/C=C/CN2CCOCC2)CC3=CC4=CC=CC=C4C=C3)C(=O)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F.Cl.Cl

InChI

InChI=1S/C32H33F6N3O2.2ClH/c33-31(34,35)27-19-26(20-28(21-27)32(36,37)38)30(42)41-12-11-40(10-4-3-9-39-13-15-43-16-14-39)22-29(41)18-23-7-8-24-5-1-2-6-25(24)17-23;;/h1-8,17,19-21,29H,9-16,18,22H2;2*1H/b4-3+;;