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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=C(C=C3)F)O.Cl.Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=CC=C(C=C3)F)O.Cl.Cl

InChI

InChI=1S/C22H29FN2O2.2ClH/c1-2-3-18-4-10-22(11-5-18)27-17-21(26)16-24-12-14-25(15-13-24)20-8-6-19(23)7-9-20;;/h4-11,21,26H,2-3,12-17H2,1H3;2*1H