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

Systemtic Name: 1-(2-tert-butyl-4-methoxy-phenoxy)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride Openeye Name: 1-(2-tert-butyl-4-methoxy-phenoxy)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride CAS Name: 1-(2-tert-butyl-4-methoxyphenoxy)-3-[4-(4-fluorophenyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-(2-tert-butyl-4-methoxyphenoxy)-3-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride Traditional Name: 1-(2-tert-butyl-4-methoxy-phenoxy)-3-[4-(4-fluorophenyl)piperazino]propan-2-ol dihydrochloride Formula: C24H35Cl2FN2O3 MolecularWeight: 489.450703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H33FN2O3.2ClH/c1-24(2,3)22-15-21(29-4)9-10-23(22)30-17-20(28)16-26-11-13-27(14-12-26)19-7-5-18(25)6-8-19;;/h5-10,15,20,28H,11-14,16-17H2,1-4H3;2*1H