2,3-bis(oxidanyl)propyl 1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxylate

Systemtic Name: 2,3-bis(oxidanyl)propyl 1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxylate Openeye Name: 2,3-dihydroxypropyl 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylate CAS Name: 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylic acid 2,3-dihydroxypropyl ester IUPAC Name: 2,3-dihydroxypropyl 1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxylate Traditional Name: 1-oxidobenzofurazan-1-ium-5-carboxylic acid glyceryl ester Formula: C10H10N2O6 MolecularWeight: 254.1962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=[N+](ON=C2C=C1C(=O)OCC(CO)O)[O-]

Isomeric SMILES

C1=CC2=[N+](ON=C2C=C1C(=O)OCC(CO)O)[O-]

InChI

InChI=1S/C10H10N2O6/c13-4-7(14)5-17-10(15)6-1-2-9-8(3-6)11-18-12(9)16/h1-3,7,13-14H,4-5H2