3-chloranyl-5-methylsulfonyl-benzoic acid

Systemtic Name: 3-chloranyl-5-methylsulfonyl-benzoic acid Openeye Name: 3-chloro-5-methylsulfonyl-benzoic acid CAS Name: 3-chloro-5-methylsulfonylbenzoic acid IUPAC Name: 3-chloro-5-methylsulfonylbenzoic acid Traditional Name: 3-chloro-5-mesyl-benzoic acid Formula: C8H7ClO4S MolecularWeight: 234.65678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7ClO4S/c1-14(12,13)7-3-5(8(10)11)2-6(9)4-7/h2-4H,1H3,(H,10,11)