2-(2-oxidanylidenepyrrolidin-1-yl)ethyl 1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxylate

Systemtic Name: 2-(2-oxidanylidenepyrrolidin-1-yl)ethyl 1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxylate Openeye Name: 2-(2-oxopyrrolidin-1-yl)ethyl 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylate CAS Name: 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylic acid 2-(2-oxo-1-pyrrolidinyl)ethyl ester IUPAC Name: 2-(2-oxopyrrolidin-1-yl)ethyl 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylate Traditional Name: 1-oxidobenzofurazan-1-ium-5-carboxylic acid 2-(2-ketopyrrolidino)ethyl ester Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCOC(=O)C2=CC3=NO[N+](=C3C=C2)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CCOC(=O)C2=CC3=NO[N+](=C3C=C2)[O-]

InChI

InChI=1S/C13H13N3O5/c17-12-2-1-5-15(12)6-7-20-13(18)9-3-4-11-10(8-9)14-21-16(11)19/h3-4,8H,1-2,5-7H2