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

Systemtic Name: [4-cyano-3,5-bis(fluoranyl)phenyl] 2-fluoranyl-4-pentyl-benzoate Openeye Name: (4-cyano-3,5-difluoro-phenyl) 2-fluoro-4-pentyl-benzoate CAS Name: 2-fluoro-4-pentylbenzoic acid (4-cyano-3,5-difluorophenyl) ester IUPAC Name: (4-cyano-3,5-difluorophenyl) 2-fluoro-4-pentylbenzoate Traditional Name: 4-amyl-2-fluoro-benzoic acid (4-cyano-3,5-difluoro-phenyl) ester Formula: C19H16F3NO2 MolecularWeight: 347.33105

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)C(=O)OC2=CC(=C(C(=C2)F)C#N)F)F

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)C(=O)OC2=CC(=C(C(=C2)F)C#N)F)F

InChI

InChI=1S/C19H16F3NO2/c1-2-3-4-5-12-6-7-14(16(20)8-12)19(24)25-13-9-17(21)15(11-23)18(22)10-13/h6-10H,2-5H2,1H3