(4-pentan-3-ylpiperazin-1-yl)-[4-[[3-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]methanone dihydrochloride

Systemtic Name: (4-pentan-3-ylpiperazin-1-yl)-[4-[[3-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]methanone dihydrochloride Openeye Name: [4-(1-ethylpropyl)piperazin-1-yl]-[4-[[3-(trifluoromethyl)-1-piperidyl]methyl]phenyl]methanone dihydrochloride CAS Name: (4-pentan-3-yl-1-piperazinyl)-[4-[[3-(trifluoromethyl)-1-piperidinyl]methyl]phenyl]methanone dihydrochloride IUPAC Name: (4-pentan-3-ylpiperazin-1-yl)-[4-[[3-(trifluoromethyl)piperidin-1-yl]methyl]phenyl]methanone dihydrochloride Traditional Name: [4-(1-ethylpropyl)piperazino]-[4-[[3-(trifluoromethyl)piperidino]methyl]phenyl]methanone dihydrochloride Formula: C23H36Cl2F3N3O MolecularWeight: 498.45265

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCCC(C3)C(F)(F)F.Cl.Cl

Isomeric SMILES

CCC(CC)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCCC(C3)C(F)(F)F.Cl.Cl

InChI

InChI=1S/C23H34F3N3O.2ClH/c1-3-21(4-2)28-12-14-29(15-13-28)22(30)19-9-7-18(8-10-19)16-27-11-5-6-20(17-27)23(24,25)26;;/h7-10,20-21H,3-6,11-17H2,1-2H3;2*1H