2-[2-[(4-fluoranyl-2-methylsulfonyl-phenyl)amino]ethanoylamino]benzoic acid

Systemtic Name: 2-[2-[(4-fluoranyl-2-methylsulfonyl-phenyl)amino]ethanoylamino]benzoic acid Openeye Name: 2-[[2-(4-fluoro-2-methylsulfonyl-anilino)acetyl]amino]benzoic acid CAS Name: 2-[[2-(4-fluoro-2-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-(4-fluoro-2-methylsulfonylanilino)acetyl]amino]benzoic acid Traditional Name: 2-[[2-(4-fluoro-2-mesyl-anilino)acetyl]amino]benzoic acid Formula: C16H15FN2O5S MolecularWeight: 366.364103

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)F)NCC(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)F)NCC(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H15FN2O5S/c1-25(23,24)14-8-10(17)6-7-13(14)18-9-15(20)19-12-5-3-2-4-11(12)16(21)22/h2-8,18H,9H2,1H3,(H,19,20)(H,21,22)