3-(1,2-oxazol-2-ium-2-yl)benzenesulfonate

Systemtic Name: 3-(1,2-oxazol-2-ium-2-yl)benzenesulfonate Openeye Name: 3-isoxazol-2-ium-2-ylbenzenesulfonate CAS Name: 3-(2-isoxazol-2-iumyl)benzenesulfonate IUPAC Name: 3-(1,2-oxazol-2-ium-2-yl)benzenesulfonate Traditional Name: 3-isoxazol-2-ium-2-ylbesylate Formula: C9H7NO4S MolecularWeight: 225.22118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+]2=CC=CO2

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+]2=CC=CO2

InChI

InChI=1S/C9H7NO4S/c11-15(12,13)9-4-1-3-8(7-9)10-5-2-6-14-10/h1-7H