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

Systemtic Name: (4-cyano-2-fluoranyl-phenyl) 4-(4-hexylcyclohexyl)benzoate Openeye Name: (4-cyano-2-fluoro-phenyl) 4-(4-hexylcyclohexyl)benzoate CAS Name: 4-(4-hexylcyclohexyl)benzoic acid (4-cyano-2-fluorophenyl) ester IUPAC Name: (4-cyano-2-fluorophenyl) 4-(4-hexylcyclohexyl)benzoate Traditional Name: 4-(4-hexylcyclohexyl)benzoic acid (4-cyano-2-fluoro-phenyl) ester Formula: C26H30FNO2 MolecularWeight: 407.520303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C26H30FNO2/c1-2-3-4-5-6-19-7-10-21(11-8-19)22-12-14-23(15-13-22)26(29)30-25-16-9-20(18-28)17-24(25)27/h9,12-17,19,21H,2-8,10-11H2,1H3