2-[(3-oxidanidyl-2,1,3-benzoxadiazol-3-ium-5-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(3-oxidanidyl-2,1,3-benzoxadiazol-3-ium-5-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(3-oxido-2,1,3-benzoxadiazol-3-ium-5-carbonyl)amino]acetic acid CAS Name: 2-[[(3-oxido-2,1,3-benzoxadiazol-3-ium-5-yl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(3-oxido-2,1,3-benzoxadiazol-3-ium-5-carbonyl)amino]acetic acid Traditional Name: 2-[(3-oxidobenzofurazan-3-ium-5-carbonyl)amino]acetic acid Formula: C9H7N3O5 MolecularWeight: 237.16898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NO[N+](=C2C=C1C(=O)NCC(=O)O)[O-]

Isomeric SMILES

C1=CC2=NO[N+](=C2C=C1C(=O)NCC(=O)O)[O-]

InChI

InChI=1S/C9H7N3O5/c13-8(14)4-10-9(15)5-1-2-6-7(3-5)12(16)17-11-6/h1-3H,4H2,(H,10,15)(H,13,14)