[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 4-cyanobenzoate

Systemtic Name: [2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl] 4-cyanobenzoate Openeye Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(trifluoromethyl)anilino]ethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-keto-2-[3-(trifluoromethyl)anilino]ethyl] ester Formula: C17H11F3N2O3 MolecularWeight: 348.27605

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C17H11F3N2O3/c18-17(19,20)13-2-1-3-14(8-13)22-15(23)10-25-16(24)12-6-4-11(9-21)5-7-12/h1-8H,10H2,(H,22,23)