[4-cyano-3,5-bis(fluoranyl)phenyl] 4-ethyl-2-fluoranyl-benzoate

Systemtic Name: [4-cyano-3,5-bis(fluoranyl)phenyl] 4-ethyl-2-fluoranyl-benzoate Openeye Name: (4-cyano-3,5-difluoro-phenyl) 4-ethyl-2-fluoro-benzoate CAS Name: 4-ethyl-2-fluorobenzoic acid (4-cyano-3,5-difluorophenyl) ester IUPAC Name: (4-cyano-3,5-difluorophenyl) 4-ethyl-2-fluorobenzoate Traditional Name: 4-ethyl-2-fluoro-benzoic acid (4-cyano-3,5-difluoro-phenyl) ester Formula: C16H10F3NO2 MolecularWeight: 305.25131

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)C(=O)OC2=CC(=C(C(=C2)F)C#N)F)F

Isomeric SMILES

CCC1=CC(=C(C=C1)C(=O)OC2=CC(=C(C(=C2)F)C#N)F)F

InChI

InChI=1S/C16H10F3NO2/c1-2-9-3-4-11(13(17)5-9)16(21)22-10-6-14(18)12(8-20)15(19)7-10/h3-7H,2H2,1H3