2-[2-[methylsulfonyl(phenyl)amino]ethanoylamino]benzoic acid

Systemtic Name: 2-[2-[methylsulfonyl(phenyl)amino]ethanoylamino]benzoic acid Openeye Name: 2-[[2-(N-methylsulfonylanilino)acetyl]amino]benzoic acid CAS Name: 2-[[2-(N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-(N-methylsulfonylanilino)acetyl]amino]benzoic acid Traditional Name: 2-[[2-(N-mesylanilino)acetyl]amino]benzoic acid Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H16N2O5S/c1-24(22,23)18(12-7-3-2-4-8-12)11-15(19)17-14-10-6-5-9-13(14)16(20)21/h2-10H,11H2,1H3,(H,17,19)(H,20,21)