2-[(2-methylsulfonylphenyl)carbonylamino]-4-(trifluoromethyl)benzoic acid

Systemtic Name: 2-[(2-methylsulfonylphenyl)carbonylamino]-4-(trifluoromethyl)benzoic acid Openeye Name: 2-[(2-methylsulfonylbenzoyl)amino]-4-(trifluoromethyl)benzoic acid CAS Name: 2-[[(2-methylsulfonylphenyl)-oxomethyl]amino]-4-(trifluoromethyl)benzoic acid IUPAC Name: 2-[(2-methylsulfonylbenzoyl)amino]-4-(trifluoromethyl)benzoic acid Traditional Name: 2-[(2-mesylbenzoyl)amino]-4-(trifluoromethyl)benzoic acid Formula: C16H12F3NO5S MolecularWeight: 387.33039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)NC2=C(C=CC(=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)NC2=C(C=CC(=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C16H12F3NO5S/c1-26(24,25)13-5-3-2-4-11(13)14(21)20-12-8-9(16(17,18)19)6-7-10(12)15(22)23/h2-8H,1H3,(H,20,21)(H,22,23)