[(3R,5S)-5-methyl-2-oxidanylidene-oxolan-3-yl] 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: [(3R,5S)-5-methyl-2-oxidanylidene-oxolan-3-yl] 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: [(3R,5S)-5-methyl-2-oxo-tetrahydrofuran-3-yl] 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid [(3R,5S)-5-methyl-2-oxo-3-oxolanyl] ester IUPAC Name: [(3R,5S)-5-methyl-2-oxooxolan-3-yl] 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid [(3R,5S)-2-keto-5-methyl-tetrahydrofuran-3-yl] ester Formula: C13H13ClO6S MolecularWeight: 332.75672

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

C[C@H]1C[C@H](C(=O)O1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C13H13ClO6S/c1-7-5-11(13(16)19-7)20-12(15)9-6-8(21(2,17)18)3-4-10(9)14/h3-4,6-7,11H,5H2,1-2H3/t7-,11+/m0/s1