[(1R)-2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 4-methylbenzoate

Systemtic Name: [(1R)-2-oxidanylidene-1-phenyl-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 4-methylbenzoate Openeye Name: [(1R)-2-oxo-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] 4-methylbenzoate CAS Name: 4-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] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(1R)-2-keto-1-phenyl-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C23H18F3NO3 MolecularWeight: 413.38913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)O[C@H](C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C23H18F3NO3/c1-15-10-12-17(13-11-15)22(29)30-20(16-6-3-2-4-7-16)21(28)27-19-9-5-8-18(14-19)23(24,25)26/h2-14,20H,1H3,(H,27,28)/t20-/m1/s1