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

Systemtic Name: [4-cyano-3,5-bis(fluoranyl)phenyl] 2-fluoranyl-4-propyl-benzoate Openeye Name: (4-cyano-3,5-difluoro-phenyl) 2-fluoro-4-propyl-benzoate CAS Name: 2-fluoro-4-propylbenzoic acid (4-cyano-3,5-difluorophenyl) ester IUPAC Name: (4-cyano-3,5-difluorophenyl) 2-fluoro-4-propylbenzoate Traditional Name: 2-fluoro-4-propyl-benzoic acid (4-cyano-3,5-difluoro-phenyl) ester Formula: C17H12F3NO2 MolecularWeight: 319.27789

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)C(=O)OC2=CC(=C(C(=C2)F)C#N)F)F

Isomeric SMILES

CCCC1=CC(=C(C=C1)C(=O)OC2=CC(=C(C(=C2)F)C#N)F)F

InChI

InChI=1S/C17H12F3NO2/c1-2-3-10-4-5-12(14(18)6-10)17(22)23-11-7-15(19)13(9-21)16(20)8-11/h4-8H,2-3H2,1H3