[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid [2-keto-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C21H21F3N2O6S MolecularWeight: 486.46145

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H21F3N2O6S/c1-14-5-6-15(11-18(14)33(29,30)26-7-9-31-10-8-26)20(28)32-13-19(27)25-17-4-2-3-16(12-17)21(22,23)24/h2-6,11-12H,7-10,13H2,1H3,(H,25,27)