N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(1-pyrrolidin-1-iumyl)ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(2-pyrrolidin-1-ium-1-ylethyl)-piperonylamide Formula: C14H19N2O3+ MolecularWeight: 263.31226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H18N2O3/c17-14(15-5-8-16-6-1-2-7-16)11-3-4-12-13(9-11)19-10-18-12/h3-4,9H,1-2,5-8,10H2,(H,15,17)/p+1