[4-(4-heptylcyclohexyl)cyclohexyl] 3-fluoranyl-4-heptoxy-benzoate

Systemtic Name: [4-(4-heptylcyclohexyl)cyclohexyl] 3-fluoranyl-4-heptoxy-benzoate Openeye Name: [4-(4-heptylcyclohexyl)cyclohexyl] 3-fluoro-4-heptoxy-benzoate CAS Name: 3-fluoro-4-heptoxybenzoic acid [4-(4-heptylcyclohexyl)cyclohexyl] ester IUPAC Name: [4-(4-heptylcyclohexyl)cyclohexyl] 3-fluoro-4-heptoxybenzoate Traditional Name: 3-fluoro-4-heptoxy-benzoic acid [4-(4-heptylcyclohexyl)cyclohexyl] ester Formula: C33H53FO3 MolecularWeight: 516.770523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC(=C(C=C3)OCCCCCCC)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC(=C(C=C3)OCCCCCCC)F

InChI

InChI=1S/C33H53FO3/c1-3-5-7-9-11-13-26-14-16-27(17-15-26)28-18-21-30(22-19-28)37-33(35)29-20-23-32(31(34)25-29)36-24-12-10-8-6-4-2/h20,23,25-28,30H,3-19,21-22,24H2,1-2H3