2-chloranyl-4-methylsulfonyl-3-oxidanyl-benzoate

Systemtic Name: 2-chloranyl-4-methylsulfonyl-3-oxidanyl-benzoate Openeye Name: 2-chloro-3-hydroxy-4-methylsulfonyl-benzoate CAS Name: 2-chloro-3-hydroxy-4-methylsulfonylbenzoate IUPAC Name: 2-chloro-3-hydroxy-4-methylsulfonylbenzoate Traditional Name: 2-chloro-3-hydroxy-4-mesyl-benzoate Formula: C8H6ClO5S- MolecularWeight: 249.64824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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