1-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium Traditional Name: 1-piperonylpiperazine-1,4-diium Formula: C12H18N2O2+2 MolecularWeight: 222.28352

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H16N2O2/c1-2-11-12(16-9-15-11)7-10(1)8-14-5-3-13-4-6-14/h1-2,7,13H,3-6,8-9H2/p+2