(2R)-1-[2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-oxidanylidene-ethyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-[2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-oxidanylidene-ethyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-1-[2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-oxo-ethyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-1-[2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-2-oxoethyl]-N,N-dimethyl-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-1-[2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-oxoethyl]-N,N-dimethylpyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-1-[2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-keto-ethyl]-N,N-dimethyl-pyrrolidin-1-ium-2-carboxamide Formula: C17H23N4O5+ MolecularWeight: 363.38832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1CCC[NH+]1CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(C)C(=O)[C@H]1CCC[NH+]1CC(=O)NC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H22N4O5/c1-20(2)16(23)12-4-3-7-21(12)9-15(22)19-17(24)18-11-5-6-13-14(8-11)26-10-25-13/h5-6,8,12H,3-4,7,9-10H2,1-2H3,(H2,18,19,22,24)/p+1/t12-/m1/s1