[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl] 3-methylsulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl] 3-methylsulfonylbenzoate Openeye Name: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid [2-keto-2-[4-(trifluoromethoxy)anilino]ethyl] ester Formula: C17H14F3NO6S MolecularWeight: 417.35637

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14F3NO6S/c1-28(24,25)14-4-2-3-11(9-14)16(23)26-10-15(22)21-12-5-7-13(8-6-12)27-17(18,19)20/h2-9H,10H2,1H3,(H,21,22)