2,5-bis(chloranyl)-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoic acid

Systemtic Name: 2,5-bis(chloranyl)-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoic acid Openeye Name: 2,5-dichloro-4-[methyl(p-tolylsulfonyl)amino]benzoic acid CAS Name: 2,5-dichloro-4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid IUPAC Name: 2,5-dichloro-4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid Traditional Name: 2,5-dichloro-4-[methyl(tosyl)amino]benzoic acid Formula: C15H13Cl2NO4S MolecularWeight: 374.23902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=C(C(=C2)Cl)C(=O)O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=C(C(=C2)Cl)C(=O)O)Cl

InChI

InChI=1S/C15H13Cl2NO4S/c1-9-3-5-10(6-4-9)23(21,22)18(2)14-8-12(16)11(15(19)20)7-13(14)17/h3-8H,1-2H3,(H,19,20)