2-chloranyl-4-ethylsulfonyl-benzoic acid

Systemtic Name: 2-chloranyl-4-ethylsulfonyl-benzoic acid Openeye Name: 2-chloro-4-ethylsulfonyl-benzoic acid CAS Name: 2-chloro-4-ethylsulfonylbenzoic acid IUPAC Name: 2-chloro-4-ethylsulfonylbenzoic acid Traditional Name: 2-chloro-4-esyl-benzoic acid Formula: C9H9ClO4S MolecularWeight: 248.68336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9ClO4S/c1-2-15(13,14)6-3-4-7(9(11)12)8(10)5-6/h3-5H,2H2,1H3,(H,11,12)