(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl) propanoate

Systemtic Name: (1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl) propanoate Openeye Name: (1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl) propanoate CAS Name: propanoic acid (1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl) ester IUPAC Name: (1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl) propanoate Traditional Name: propionic acid (1-oxidobenzofurazan-1-ium-5-yl) ester Formula: C9H8N2O4 MolecularWeight: 208.17082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC2=NO[N+](=C2C=C1)[O-]

Isomeric SMILES

CCC(=O)OC1=CC2=NO[N+](=C2C=C1)[O-]

InChI

InChI=1S/C9H8N2O4/c1-2-9(12)14-6-3-4-8-7(5-6)10-15-11(8)13/h3-5H,2H2,1H3