2-(3-chloranyl-4-methylsulfonyl-phenyl)ethanoic acid

Systemtic Name: 2-(3-chloranyl-4-methylsulfonyl-phenyl)ethanoic acid Openeye Name: 2-(3-chloro-4-methylsulfonyl-phenyl)acetic acid CAS Name: 2-(3-chloro-4-methylsulfonylphenyl)acetic acid IUPAC Name: 2-(3-chloro-4-methylsulfonylphenyl)acetic acid Traditional Name: 2-(3-chloro-4-mesyl-phenyl)acetic acid Formula: C9H9ClO4S MolecularWeight: 248.68336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9ClO4S/c1-15(13,14)8-3-2-6(4-7(8)10)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)