2-(1,3-benzodioxol-5-ylcarbonylamino)ethyl-dimethyl-azanium

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbonylamino)ethyl-dimethyl-azanium Openeye Name: 2-(1,3-benzodioxole-5-carbonylamino)ethyl-dimethyl-ammonium CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-(1,3-benzodioxole-5-carbonylamino)ethyl-dimethylazanium Traditional Name: dimethyl-[2-(piperonyloylamino)ethyl]ammonium Formula: C12H17N2O3+ MolecularWeight: 237.27498

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H16N2O3/c1-14(2)6-5-13-12(15)9-3-4-10-11(7-9)17-8-16-10/h3-4,7H,5-6,8H2,1-2H3,(H,13,15)/p+1