1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazine; ethanedioic acid

Systemtic Name: 1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazine; ethanedioic acid Openeye Name: 1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazine; oxalic acid CAS Name: 1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazine; oxalic acid IUPAC Name: 1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazine; oxalic acid Traditional Name: 1,4-dipiperonylpiperazine; oxalic acid Formula: C22H24N2O8 MolecularWeight: 444.43456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H22N2O4.C2H2O4/c1-3-17-19(25-13-23-17)9-15(1)11-21-5-7-22(8-6-21)12-16-2-4-18-20(10-16)26-14-24-18;3-1(4)2(5)6/h1-4,9-10H,5-8,11-14H2;(H,3,4)(H,5,6)