[1-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl] 3-cyanobenzoate

Systemtic Name: [1-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl] 3-cyanobenzoate Openeye Name: [2-(3,4-difluorophenyl)-1-methyl-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [1-(3,4-difluorophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,4-difluorophenyl)-1-oxopropan-2-yl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(3,4-difluorophenyl)-2-keto-1-methyl-ethyl] ester Formula: C17H11F2NO3 MolecularWeight: 315.270946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11F2NO3/c1-10(16(21)12-5-6-14(18)15(19)8-12)23-17(22)13-4-2-3-11(7-13)9-20/h2-8,10H,1H3