[(2R)-1-oxidanylidene-1-[[4-(trifluoromethyloxy)phenyl]amino]propan-2-yl] 4-cyanobenzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-[[4-(trifluoromethyloxy)phenyl]amino]propan-2-yl] 4-cyanobenzoate Openeye Name: [(1R)-1-methyl-2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [(2R)-1-oxo-1-[4-(trifluoromethoxy)anilino]propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-[4-(trifluoromethoxy)anilino]propan-2-yl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [(1R)-2-keto-1-methyl-2-[4-(trifluoromethoxy)anilino]ethyl] ester Formula: C18H13F3N2O4 MolecularWeight: 378.30203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC(F)(F)F)OC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OC(F)(F)F)OC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H13F3N2O4/c1-11(26-17(25)13-4-2-12(10-22)3-5-13)16(24)23-14-6-8-15(9-7-14)27-18(19,20)21/h2-9,11H,1H3,(H,23,24)/t11-/m1/s1