1-(2-butan-2-ylphenoxy)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride

Systemtic Name: 1-(2-butan-2-ylphenoxy)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(2-sec-butylphenoxy)propan-2-ol dihydrochloride CAS Name: 1-(2-butan-2-ylphenoxy)-3-[4-(4-fluorophenyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-(2-butan-2-ylphenoxy)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-3-(2-sec-butylphenoxy)propan-2-ol dihydrochloride Formula: C23H33Cl2FN2O2 MolecularWeight: 459.424723

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC(CN2CCN(CC2)C3=CC=C(C=C3)F)O.Cl.Cl

Isomeric SMILES

CCC(C)C1=CC=CC=C1OCC(CN2CCN(CC2)C3=CC=C(C=C3)F)O.Cl.Cl

InChI

InChI=1S/C23H31FN2O2.2ClH/c1-3-18(2)22-6-4-5-7-23(22)28-17-21(27)16-25-12-14-26(15-13-25)20-10-8-19(24)9-11-20;;/h4-11,18,21,27H,3,12-17H2,1-2H3;2*1H