1-methyl-4-[[5-(3-phenylpropoxy)-1,3-benzodioxol-4-yl]methyl]piperazine dihydrochloride

Systemtic Name: 1-methyl-4-[[5-(3-phenylpropoxy)-1,3-benzodioxol-4-yl]methyl]piperazine dihydrochloride Openeye Name: 1-methyl-4-[[5-(3-phenylpropoxy)-1,3-benzodioxol-4-yl]methyl]piperazine dihydrochloride CAS Name: 1-methyl-4-[[5-(3-phenylpropoxy)-1,3-benzodioxol-4-yl]methyl]piperazine dihydrochloride IUPAC Name: 1-methyl-4-[[5-(3-phenylpropoxy)-1,3-benzodioxol-4-yl]methyl]piperazine dihydrochloride Traditional Name: 1-methyl-4-[[5-(3-phenylpropoxy)-1,3-benzodioxol-4-yl]methyl]piperazine dihydrochloride Formula: C22H30Cl2N2O3 MolecularWeight: 441.3912

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C=CC3=C2OCO3)OCCCC4=CC=CC=C4.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)CC2=C(C=CC3=C2OCO3)OCCCC4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C22H28N2O3.2ClH/c1-23-11-13-24(14-12-23)16-19-20(9-10-21-22(19)27-17-26-21)25-15-5-8-18-6-3-2-4-7-18;;/h2-4,6-7,9-10H,5,8,11-17H2,1H3;2*1H