(4-cyano-2-fluoranyl-phenyl) 4-(4-pentylcyclohexyl)benzoate

Systemtic Name: (4-cyano-2-fluoranyl-phenyl) 4-(4-pentylcyclohexyl)benzoate Openeye Name: (4-cyano-2-fluoro-phenyl) 4-(4-pentylcyclohexyl)benzoate CAS Name: 4-(4-pentylcyclohexyl)benzoic acid (4-cyano-2-fluorophenyl) ester IUPAC Name: (4-cyano-2-fluorophenyl) 4-(4-pentylcyclohexyl)benzoate Traditional Name: 4-(4-amylcyclohexyl)benzoic acid (4-cyano-2-fluoro-phenyl) ester Formula: C25H28FNO2 MolecularWeight: 393.493723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28FNO2/c1-2-3-4-5-18-6-9-20(10-7-18)21-11-13-22(14-12-21)25(28)29-24-15-8-19(17-27)16-23(24)26/h8,11-16,18,20H,2-7,9-10H2,1H3