[4-(2-fluoranyloctoxy)phenyl] 4-octylcyclohexane-1-carboxylate

Systemtic Name: [4-(2-fluoranyloctoxy)phenyl] 4-octylcyclohexane-1-carboxylate Openeye Name: [4-(2-fluorooctoxy)phenyl] 4-octylcyclohexanecarboxylate CAS Name: 4-octyl-1-cyclohexanecarboxylic acid [4-(2-fluorooctoxy)phenyl] ester IUPAC Name: [4-(2-fluorooctoxy)phenyl] 4-octylcyclohexane-1-carboxylate Traditional Name: 4-octylcyclohexanecarboxylic acid [4-(2-fluorooctoxy)phenyl] ester Formula: C29H47FO3 MolecularWeight: 462.680083

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCC(CCCCCC)F

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)OCC(CCCCCC)F

InChI

InChI=1S/C29H47FO3/c1-3-5-7-9-10-11-13-24-15-17-25(18-16-24)29(31)33-28-21-19-27(20-22-28)32-23-26(30)14-12-8-6-4-2/h19-22,24-26H,3-18,23H2,1-2H3