2-[(5-oxidanidyl-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(5-oxidanidyl-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]acetic acid CAS Name: 2-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)thio]acetic acid IUPAC Name: 2-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(5-oxido-4-phenyl-furazan-5-ium-3-yl)thio]acetic acid Formula: C10H8N2O4S MolecularWeight: 252.24652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[N+](ON=C2SCC(=O)O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=[N+](ON=C2SCC(=O)O)[O-]

InChI

InChI=1S/C10H8N2O4S/c13-8(14)6-17-10-9(12(15)16-11-10)7-4-2-1-3-5-7/h1-5H,6H2,(H,13,14)