2D Structure | |
CID | 2329132 |
Target | / |
IUPAC Name | 2-chloro-5-methylsulfonylbenzoic acid |
InChI | InChI=1S/C8H7ClO4S/c1-14(12,13)5-2-3-7(9)6(4-5)8(10)11/h2-4H,1H3,(H,10,11) |
InChI Key | SKWDIXBVQATQSG-UHFFFAOYSA-N |
Canonical SMILES | CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)O |
Isomeric SMILES | CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)O |
Molecular Formula | C8H7ClO4S |
Molecular Weight | 234.66 |
synonyms | ['2-Chloro-5-(methylsulphonyl)benzoic acid', '630-094-4', '2-chloro-5-(methylsulfonyl)benzoic acid', '89938-62-5', '2-chloro-5-methylsulfonylbenzoic acid', '2-chloro-5-methanesulfonylbenzoic acid', 'MLS000054474', 'MFCD02711523', 'Enamine_001737', 'Benzoic acid, 2-chloro-5-(methylsulfonyl)-', 'SCHEMBL34694', 'CHEMBL1442647', 'DTXSID30368125', 'HMS1398O21', 'HMS2490B16', 'AR3170', 'XH1522', '5-methanesulfonyl-2-chlorobenzoic acid', 'AKOS000117870', '2-Chloro-5-(methylsulfonyl)benzoicacid', '2-chloro-5-methanesulfonyl-benzoic acid', '2-chloro-5-(methanesulfonyl)benzoic acid', '2-chloro-5-(methylsulfonyl)-benzoic acid', 'BS-13914', 'SMR000060819', 'DB-078553', 'CS-0046922', 'EN300-10082', 'SR-01000030116', 'SR-01000030116-1', 'Z56347156'] |
From Pubchem