[4-(4-fluoranylbutyl)cyclohexyl] 4-[4-(4-chloranylbutyl)cyclohexyl]benzoate

Systemtic Name: [4-(4-fluoranylbutyl)cyclohexyl] 4-[4-(4-chloranylbutyl)cyclohexyl]benzoate Openeye Name: [4-(4-fluorobutyl)cyclohexyl] 4-[4-(4-chlorobutyl)cyclohexyl]benzoate CAS Name: 4-[4-(4-chlorobutyl)cyclohexyl]benzoic acid [4-(4-fluorobutyl)cyclohexyl] ester IUPAC Name: [4-(4-fluorobutyl)cyclohexyl] 4-[4-(4-chlorobutyl)cyclohexyl]benzoate Traditional Name: 4-[4-(4-chlorobutyl)cyclohexyl]benzoic acid [4-(4-fluorobutyl)cyclohexyl] ester Formula: C27H40ClFO2 MolecularWeight: 451.056703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCCCCl)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCCCF

Isomeric SMILES

C1CC(CCC1CCCCCl)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCCCF

InChI

InChI=1S/C27H40ClFO2/c28-19-3-1-5-21-7-11-23(12-8-21)24-13-15-25(16-14-24)27(30)31-26-17-9-22(10-18-26)6-2-4-20-29/h13-16,21-23,26H,1-12,17-20H2