4-[(2-chloranyl-5-methylsulfonyl-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 4-[(2-chloranyl-5-methylsulfonyl-phenyl)sulfonylamino]benzoic acid Openeye Name: 4-[(2-chloro-5-methylsulfonyl-phenyl)sulfonylamino]benzoic acid CAS Name: 4-[(2-chloro-5-methylsulfonylphenyl)sulfonylamino]benzoic acid IUPAC Name: 4-[(2-chloro-5-methylsulfonylphenyl)sulfonylamino]benzoic acid Traditional Name: 4-[(2-chloro-5-mesyl-phenyl)sulfonylamino]benzoic acid Formula: C14H12ClNO6S2 MolecularWeight: 389.83118

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H12ClNO6S2/c1-23(19,20)11-6-7-12(15)13(8-11)24(21,22)16-10-4-2-9(3-5-10)14(17)18/h2-8,16H,1H3,(H,17,18)