(1-chloranyl-1-oxidanylidene-propan-2-yl) benzenesulfonate

Systemtic Name: (1-chloranyl-1-oxidanylidene-propan-2-yl) benzenesulfonate Openeye Name: (2-chloro-1-methyl-2-oxo-ethyl) benzenesulfonate CAS Name: benzenesulfonic acid (1-chloro-1-oxopropan-2-yl) ester IUPAC Name: (1-chloro-1-oxopropan-2-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (2-chloro-2-keto-1-methyl-ethyl) ester Formula: C9H9ClO4S MolecularWeight: 248.68336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)Cl)OS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C(=O)Cl)OS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C9H9ClO4S/c1-7(9(10)11)14-15(12,13)8-5-3-2-4-6-8/h2-7H,1H3