3-[(4-methylsulfonylphenyl)amino]benzoic acid

Systemtic Name: 3-[(4-methylsulfonylphenyl)amino]benzoic acid Openeye Name: 3-(4-methylsulfonylanilino)benzoic acid CAS Name: 3-(4-methylsulfonylanilino)benzoic acid IUPAC Name: 3-(4-methylsulfonylanilino)benzoic acid Traditional Name: 3-(4-mesylanilino)benzoic acid Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13NO4S/c1-20(18,19)13-7-5-11(6-8-13)15-12-4-2-3-10(9-12)14(16)17/h2-9,15H,1H3,(H,16,17)