(2-oxidanylideneoxolan-3-yl) 4-chloranyl-3-methylsulfonyl-benzoate

Systemtic Name: (2-oxidanylideneoxolan-3-yl) 4-chloranyl-3-methylsulfonyl-benzoate Openeye Name: (2-oxotetrahydrofuran-3-yl) 4-chloro-3-methylsulfonyl-benzoate CAS Name: 4-chloro-3-methylsulfonylbenzoic acid (2-oxo-3-oxolanyl) ester IUPAC Name: (2-oxooxolan-3-yl) 4-chloro-3-methylsulfonylbenzoate Traditional Name: 4-chloro-3-mesyl-benzoic acid (2-ketotetrahydrofuran-3-yl) ester Formula: C12H11ClO6S MolecularWeight: 318.73014

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)OC2CCOC2=O)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)OC2CCOC2=O)Cl

InChI

InChI=1S/C12H11ClO6S/c1-20(16,17)10-6-7(2-3-8(10)13)11(14)19-9-4-5-18-12(9)15/h2-3,6,9H,4-5H2,1H3