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

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenylmethoxy-propan-2-ol dichloride Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-benzyloxy-propan-2-ol dichloride CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-phenylmethoxy-2-propanol dichloride IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-phenylmethoxypropan-2-ol dichloride Traditional Name: 1-benzoxy-3-(4-piperonylpiperazino)propan-2-ol dichloride Formula: C22H28Cl2N2O4-2 MolecularWeight: 455.37472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(COCC4=CC=CC=C4)O.[Cl-].[Cl-]

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(COCC4=CC=CC=C4)O.[Cl-].[Cl-]

InChI

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