1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium

Systemtic Name: 1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium Openeye Name: 1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium CAS Name: 1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium IUPAC Name: 1,4-bis(1,3-benzodioxol-5-ylmethyl)piperazin-1-ium Traditional Name: 1,4-dipiperonylpiperazin-1-ium Formula: C20H23N2O4+ MolecularWeight: 355.40762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H22N2O4/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/h1-4,9-10H,5-8,11-14H2/p+1