[3-fluoranyl-4-[2-(4-propylcyclohexyl)ethyl]phenyl] 4-pentylcyclohexane-1-carboxylate

Systemtic Name: [3-fluoranyl-4-[2-(4-propylcyclohexyl)ethyl]phenyl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [3-fluoro-4-[2-(4-propylcyclohexyl)ethyl]phenyl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [3-fluoro-4-[2-(4-propylcyclohexyl)ethyl]phenyl] ester IUPAC Name: [3-fluoro-4-[2-(4-propylcyclohexyl)ethyl]phenyl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [3-fluoro-4-[2-(4-propylcyclohexyl)ethyl]phenyl] ester Formula: C29H45FO2 MolecularWeight: 444.664803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(=O)OC2=CC(=C(C=C2)CCC3CCC(CC3)CCC)F

Isomeric SMILES

CCCCCC1CCC(CC1)C(=O)OC2=CC(=C(C=C2)CCC3CCC(CC3)CCC)F

InChI

InChI=1S/C29H45FO2/c1-3-5-6-8-23-14-17-26(18-15-23)29(31)32-27-20-19-25(28(30)21-27)16-13-24-11-9-22(7-4-2)10-12-24/h19-24,26H,3-18H2,1-2H3