2,3,6-tris(chloranyl)-5-(methylsulfonylmethylamino)benzoic acid

Systemtic Name: 2,3,6-tris(chloranyl)-5-(methylsulfonylmethylamino)benzoic acid Openeye Name: 2,3,6-trichloro-5-(methylsulfonylmethylamino)benzoic acid CAS Name: 2,3,6-trichloro-5-(methylsulfonylmethylamino)benzoic acid IUPAC Name: 2,3,6-trichloro-5-(methylsulfonylmethylamino)benzoic acid Traditional Name: 2,3,6-trichloro-5-(mesylmethylamino)benzoic acid Formula: C9H8Cl3NO4S MolecularWeight: 332.58812

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CNC1=CC(=C(C(=C1Cl)C(=O)O)Cl)Cl

Isomeric SMILES

CS(=O)(=O)CNC1=CC(=C(C(=C1Cl)C(=O)O)Cl)Cl

InChI

InChI=1S/C9H8Cl3NO4S/c1-18(16,17)3-13-5-2-4(10)7(11)6(8(5)12)9(14)15/h2,13H,3H2,1H3,(H,14,15)