1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenyl-ethyl)piperazin-1-yl]butan-1-one dihydrochloride

Systemtic Name: 1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenyl-ethyl)piperazin-1-yl]butan-1-one dihydrochloride Openeye Name: 1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenyl-ethyl)piperazin-1-yl]butan-1-one dihydrochloride CAS Name: 1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenylethyl)-1-piperazinyl]-1-butanone dihydrochloride IUPAC Name: 1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenylethyl)piperazin-1-yl]butan-1-one dihydrochloride Traditional Name: 1-(4-chlorophenyl)-4-[4-(2-methoxy-2-phenyl-ethyl)piperazino]butan-1-one dihydrochloride Formula: C23H31Cl3N2O2 MolecularWeight: 473.86344

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

COC(CN1CCN(CC1)CCCC(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C23H29ClN2O2.2ClH/c1-28-23(20-6-3-2-4-7-20)18-26-16-14-25(15-17-26)13-5-8-22(27)19-9-11-21(24)12-10-19;;/h2-4,6-7,9-12,23H,5,8,13-18H2,1H3;2*1H