methyl 3-oxidanidyl-2,1,3-benzoxadiazol-3-ium-5-carboxylate

Systemtic Name: methyl 3-oxidanidyl-2,1,3-benzoxadiazol-3-ium-5-carboxylate Openeye Name: methyl 3-oxido-2,1,3-benzoxadiazol-3-ium-5-carboxylate CAS Name: 3-oxido-2,1,3-benzoxadiazol-3-ium-5-carboxylic acid methyl ester IUPAC Name: methyl 3-oxido-2,1,3-benzoxadiazol-3-ium-5-carboxylate Traditional Name: 3-oxidobenzofurazan-3-ium-5-carboxylic acid methyl ester Formula: C8H6N2O4 MolecularWeight: 194.14424

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=[N+](ON=C2C=C1)[O-]

Isomeric SMILES

COC(=O)C1=CC2=[N+](ON=C2C=C1)[O-]

InChI

InChI=1S/C8H6N2O4/c1-13-8(11)5-2-3-6-7(4-5)10(12)14-9-6/h2-4H,1H3