1-(2-tert-butylphenoxy)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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