4-[4-(1-butan-2-yloxy-2-phenyl-ethyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one dihydrochloride

Systemtic Name: 4-[4-(1-butan-2-yloxy-2-phenyl-ethyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one dihydrochloride Openeye Name: 1-(4-fluorophenyl)-4-[4-(2-phenyl-1-sec-butoxy-ethyl)piperazin-1-yl]butan-1-one dihydrochloride CAS Name: 4-[4-(1-butan-2-yloxy-2-phenylethyl)-1-piperazinyl]-1-(4-fluorophenyl)-1-butanone dihydrochloride IUPAC Name: 4-[4-(1-butan-2-yloxy-2-phenylethyl)piperazin-1-yl]-1-(4-fluorophenyl)butan-1-one dihydrochloride Traditional Name: 1-(4-fluorophenyl)-4-[4-(2-phenyl-1-sec-butoxy-ethyl)piperazino]butan-1-one dihydrochloride Formula: C26H37Cl2FN2O2 MolecularWeight: 499.488583

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(CC1=CC=CC=C1)N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F.Cl.Cl

Isomeric SMILES

CCC(C)OC(CC1=CC=CC=C1)N2CCN(CC2)CCCC(=O)C3=CC=C(C=C3)F.Cl.Cl

InChI

InChI=1S/C26H35FN2O2.2ClH/c1-3-21(2)31-26(20-22-8-5-4-6-9-22)29-18-16-28(17-19-29)15-7-10-25(30)23-11-13-24(27)14-12-23;;/h4-6,8-9,11-14,21,26H,3,7,10,15-20H2,1-2H3;2*1H