1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol dihydrochloride

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol dihydrochloride Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-isopropylphenoxy)propan-2-ol dihydrochloride CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-(4-propan-2-ylphenoxy)-2-propanol dihydrochloride IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(4-propan-2-ylphenoxy)propan-2-ol dihydrochloride Traditional Name: 1-(4-isopropylphenoxy)-3-(4-piperonylpiperazino)propan-2-ol dihydrochloride Formula: C24H34Cl2N2O4 MolecularWeight: 485.44376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC(CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)O.Cl.Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC(CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)O.Cl.Cl

InChI

InChI=1S/C24H32N2O4.2ClH/c1-18(2)20-4-6-22(7-5-20)28-16-21(27)15-26-11-9-25(10-12-26)14-19-3-8-23-24(13-19)30-17-29-23;;/h3-8,13,18,21,27H,9-12,14-17H2,1-2H3;2*1H