3-chloranyl-4-methylsulfonyloxy-benzoate

Systemtic Name: 3-chloranyl-4-methylsulfonyloxy-benzoate Openeye Name: 3-chloro-4-methylsulfonyloxy-benzoate CAS Name: 3-chloro-4-methylsulfonyloxybenzoate IUPAC Name: 3-chloro-4-methylsulfonyloxybenzoate Traditional Name: 3-chloro-4-methylsulfonyloxy-benzoate Formula: C8H6ClO5S- MolecularWeight: 249.64824

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=C(C=C(C=C1)C(=O)[O-])Cl

Isomeric SMILES

CS(=O)(=O)OC1=C(C=C(C=C1)C(=O)[O-])Cl

InChI

InChI=1S/C8H7ClO5S/c1-15(12,13)14-7-3-2-5(8(10)11)4-6(7)9/h2-4H,1H3,(H,10,11)/p-1