2-methoxy-5-(4-oxidanylidene-1,2-oxazol-3-yl)benzenesulfonic acid

Systemtic Name: 2-methoxy-5-(4-oxidanylidene-1,2-oxazol-3-yl)benzenesulfonic acid Openeye Name: 2-methoxy-5-(4-oxoisoxazol-3-yl)benzenesulfonic acid CAS Name: 2-methoxy-5-(4-oxo-3-isoxazolyl)benzenesulfonic acid IUPAC Name: 2-methoxy-5-(4-oxo-1,2-oxazol-3-yl)benzenesulfonic acid Traditional Name: 5-(4-keto-2-isoxazolin-3-yl)-2-methoxy-besylic acid Formula: C10H9NO6S MolecularWeight: 271.24656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOCC2=O)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOCC2=O)S(=O)(=O)O

InChI

InChI=1S/C10H9NO6S/c1-16-8-3-2-6(4-9(8)18(13,14)15)10-7(12)5-17-11-10/h2-4H,5H2,1H3,(H,13,14,15)