[(1R)-2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 2-acetamido-3-methyl-benzoate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 2-acetamido-3-methyl-benzoate Openeye Name: [(1R)-2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 2-acetamido-3-methyl-benzoate CAS Name: 2-acetamido-3-methylbenzoic acid [(1R)-2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [(1R)-2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 2-acetamido-3-methylbenzoate Traditional Name: 2-acetamido-3-methyl-benzoic acid [(1R)-2-keto-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C25H21F3N2O4 MolecularWeight: 470.44045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NC(=O)C)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=CC(=C1NC(=O)C)C(=O)O[C@H](C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C25H21F3N2O4/c1-15-8-6-13-20(21(15)29-16(2)31)24(33)34-22(17-9-4-3-5-10-17)23(32)30-19-12-7-11-18(14-19)25(26,27)28/h3-14,22H,1-2H3,(H,29,31)(H,30,32)/t22-/m1/s1