2-fluoranyl-4-(4-pentylcyclohexyl)-4-[2-[1-(4-propylcyclohexyl)ethyl]phenyl]cyclohexane-1-carboxylate

Systemtic Name: 2-fluoranyl-4-(4-pentylcyclohexyl)-4-[2-[1-(4-propylcyclohexyl)ethyl]phenyl]cyclohexane-1-carboxylate Openeye Name: 2-fluoro-4-(4-pentylcyclohexyl)-4-[2-[1-(4-propylcyclohexyl)ethyl]phenyl]cyclohexanecarboxylate CAS Name: 2-fluoro-4-(4-pentylcyclohexyl)-4-[2-[1-(4-propylcyclohexyl)ethyl]phenyl]-1-cyclohexanecarboxylate IUPAC Name: 2-fluoro-4-(4-pentylcyclohexyl)-4-[2-[1-(4-propylcyclohexyl)ethyl]phenyl]cyclohexane-1-carboxylate Traditional Name: 4-(4-amylcyclohexyl)-2-fluoro-4-[2-[1-(4-propylcyclohexyl)ethyl]phenyl]cyclohexanecarboxylate Formula: C35H54FO2- MolecularWeight: 525.800463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2(CCC(C(C2)F)C(=O)[O-])C3=CC=CC=C3C(C)C4CCC(CC4)CCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2(CCC(C(C2)F)C(=O)[O-])C3=CC=CC=C3C(C)C4CCC(CC4)CCC

InChI

InChI=1S/C35H55FO2/c1-4-6-7-11-27-16-20-29(21-17-27)35(23-22-31(34(37)38)33(36)24-35)32-13-9-8-12-30(32)25(3)28-18-14-26(10-5-2)15-19-28/h8-9,12-13,25-29,31,33H,4-7,10-11,14-24H2,1-3H3,(H,37,38)/p-1