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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-[4-(phenylmethyl)piperazin-1-yl]propan-2-ol dihydrochloride Openeye Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-(4-benzylpiperazin-1-yl)propan-2-ol dihydrochloride CAS Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-[4-(phenylmethyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-(1,3-benzodioxol-5-ylmethoxy)-3-(4-benzylpiperazin-1-yl)propan-2-ol dihydrochloride Traditional Name: 1-(4-benzylpiperazino)-3-piperonyloxy-propan-2-ol dihydrochloride Formula: C22H30Cl2N2O4 MolecularWeight: 457.3906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC(COCC3=CC4=C(C=C3)OCO4)O.Cl.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC(COCC3=CC4=C(C=C3)OCO4)O.Cl.Cl

InChI

InChI=1S/C22H28N2O4.2ClH/c25-20(16-26-15-19-6-7-21-22(12-19)28-17-27-21)14-24-10-8-23(9-11-24)13-18-4-2-1-3-5-18;;/h1-7,12,20,25H,8-11,13-17H2;2*1H