2-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)sulfonylbenzoic acid

Systemtic Name: 2-(2-methyl-1-oxidanyl-1-oxidanylidene-propan-2-yl)sulfonylbenzoic acid Openeye Name: 2-(2-hydroxy-1,1-dimethyl-2-oxo-ethyl)sulfonylbenzoic acid CAS Name: 2-(1-hydroxy-2-methyl-1-oxopropan-2-yl)sulfonylbenzoic acid IUPAC Name: 2-(1-hydroxy-2-methyl-1-oxopropan-2-yl)sulfonylbenzoic acid Traditional Name: 2-(2-hydroxy-2-keto-1,1-dimethyl-ethyl)sulfonylbenzoic acid Formula: C11H12O6S MolecularWeight: 272.27438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)S(=O)(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)(C(=O)O)S(=O)(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C11H12O6S/c1-11(2,10(14)15)18(16,17)8-6-4-3-5-7(8)9(12)13/h3-6H,1-2H3,(H,12,13)(H,14,15)