[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 3-methylsulfonylbenzoate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C17H14F3NO5S MolecularWeight: 401.35697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14F3NO5S/c1-27(24,25)14-7-2-4-11(8-14)16(23)26-10-15(22)21-13-6-3-5-12(9-13)17(18,19)20/h2-9H,10H2,1H3,(H,21,22)