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

Systemtic Name: [3-fluoranyl-4-[2-(4-pentylcyclohexyl)ethyl]phenyl] 4-pentylcyclohexane-1-carboxylate Openeye Name: [3-fluoro-4-[2-(4-pentylcyclohexyl)ethyl]phenyl] 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid [3-fluoro-4-[2-(4-pentylcyclohexyl)ethyl]phenyl] ester IUPAC Name: [3-fluoro-4-[2-(4-pentylcyclohexyl)ethyl]phenyl] 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid [4-[2-(4-amylcyclohexyl)ethyl]-3-fluoro-phenyl] ester Formula: C31H49FO2 MolecularWeight: 472.717963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC2=C(C=C(C=C2)OC(=O)C3CCC(CC3)CCCCC)F

Isomeric SMILES

CCCCCC1CCC(CC1)CCC2=C(C=C(C=C2)OC(=O)C3CCC(CC3)CCCCC)F

InChI

InChI=1S/C31H49FO2/c1-3-5-7-9-24-11-13-26(14-12-24)15-18-27-21-22-29(23-30(27)32)34-31(33)28-19-16-25(17-20-28)10-8-6-4-2/h21-26,28H,3-20H2,1-2H3