(2-fluoranyl-4-pentyl-phenyl) 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: (2-fluoranyl-4-pentyl-phenyl) 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (2-fluoro-4-pentyl-phenyl) 4-(4-pentylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-pentylcyclohexyl)-1-cyclohexanecarboxylic acid (2-fluoro-4-pentylphenyl) ester IUPAC Name: (2-fluoro-4-pentylphenyl) 4-(4-pentylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-amylcyclohexyl)cyclohexanecarboxylic acid (4-amyl-2-fluoro-phenyl) ester Formula: C29H45FO2 MolecularWeight: 444.664803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C=C(C=C3)CCCCC)F

InChI

InChI=1S/C29H45FO2/c1-3-5-7-9-22-11-14-24(15-12-22)25-16-18-26(19-17-25)29(31)32-28-20-13-23(21-27(28)30)10-8-6-4-2/h13,20-22,24-26H,3-12,14-19H2,1-2H3