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

Systemtic Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol dihydrochloride Openeye Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-isopropylphenoxy)propan-2-ol dihydrochloride CAS Name: 1-[4-(4-fluorophenyl)-1-piperazinyl]-3-(4-propan-2-ylphenoxy)-2-propanol dihydrochloride IUPAC Name: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol dihydrochloride Traditional Name: 1-[4-(4-fluorophenyl)piperazino]-3-(4-isopropylphenoxy)propan-2-ol dihydrochloride Formula: C22H31Cl2FN2O2 MolecularWeight: 445.398143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29FN2O2.2ClH/c1-17(2)18-3-9-22(10-4-18)27-16-21(26)15-24-11-13-25(14-12-24)20-7-5-19(23)6-8-20;;/h3-10,17,21,26H,11-16H2,1-2H3;2*1H