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

Systemtic Name: [4-cyano-3,5-bis(fluoranyl)phenyl] 2-fluoranyl-4-(4-pentylcyclohexyl)benzoate Openeye Name: (4-cyano-3,5-difluoro-phenyl) 2-fluoro-4-(4-pentylcyclohexyl)benzoate CAS Name: 2-fluoro-4-(4-pentylcyclohexyl)benzoic acid (4-cyano-3,5-difluorophenyl) ester IUPAC Name: (4-cyano-3,5-difluorophenyl) 2-fluoro-4-(4-pentylcyclohexyl)benzoate Traditional Name: 4-(4-amylcyclohexyl)-2-fluoro-benzoic acid (4-cyano-3,5-difluoro-phenyl) ester Formula: C25H26F3NO2 MolecularWeight: 429.47465

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC(=C(C=C2)C(=O)OC3=CC(=C(C(=C3)F)C#N)F)F

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC(=C(C=C2)C(=O)OC3=CC(=C(C(=C3)F)C#N)F)F

InChI

InChI=1S/C25H26F3NO2/c1-2-3-4-5-16-6-8-17(9-7-16)18-10-11-20(22(26)12-18)25(30)31-19-13-23(27)21(15-29)24(28)14-19/h10-14,16-17H,2-9H2,1H3