[2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-[3,4-bis(fluoranyl)phenyl]-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-(3,4-difluorophenyl)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(3,4-difluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-difluorophenyl)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(3,4-difluorophenyl)-2-keto-ethyl] ester Formula: C16H9F2NO3 MolecularWeight: 301.244366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)OCC(=O)C2=CC(=C(C=C2)F)F

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)OCC(=O)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C16H9F2NO3/c17-13-6-5-12(7-14(13)18)15(20)9-22-16(21)11-3-1-10(8-19)2-4-11/h1-7H,9H2