1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methanone

Systemtic Name: 1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methanone Openeye Name: 1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methanone CAS Name: 1,3-benzodioxol-5-yl(1-piperazin-4-iumyl)methanone IUPAC Name: 1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methanone Traditional Name: 1,3-benzodioxol-5-yl(piperazin-4-ium-1-yl)methanone Formula: C12H15N2O3+ MolecularWeight: 235.2591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H14N2O3/c15-12(14-5-3-13-4-6-14)9-1-2-10-11(7-9)17-8-16-10/h1-2,7,13H,3-6,8H2/p+1