[4-cyano-2,3-bis(fluoranyl)phenyl] 4-(1-octylcyclohexyl)benzoate

Systemtic Name: [4-cyano-2,3-bis(fluoranyl)phenyl] 4-(1-octylcyclohexyl)benzoate Openeye Name: (4-cyano-2,3-difluoro-phenyl) 4-(1-octylcyclohexyl)benzoate CAS Name: 4-(1-octylcyclohexyl)benzoic acid (4-cyano-2,3-difluorophenyl) ester IUPAC Name: (4-cyano-2,3-difluorophenyl) 4-(1-octylcyclohexyl)benzoate Traditional Name: 4-(1-octylcyclohexyl)benzoic acid (4-cyano-2,3-difluoro-phenyl) ester Formula: C28H33F2NO2 MolecularWeight: 453.563926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1(CCCCC1)C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

Isomeric SMILES

CCCCCCCCC1(CCCCC1)C2=CC=C(C=C2)C(=O)OC3=C(C(=C(C=C3)C#N)F)F

InChI

InChI=1S/C28H33F2NO2/c1-2-3-4-5-6-8-17-28(18-9-7-10-19-28)23-14-11-21(12-15-23)27(32)33-24-16-13-22(20-31)25(29)26(24)30/h11-16H,2-10,17-19H2,1H3