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

Systemtic Name: [4-(4-octylcyclohexyl)cyclohexyl] 3-fluoranyl-4-heptoxy-benzoate Openeye Name: [4-(4-octylcyclohexyl)cyclohexyl] 3-fluoro-4-heptoxy-benzoate CAS Name: 3-fluoro-4-heptoxybenzoic acid [4-(4-octylcyclohexyl)cyclohexyl] ester IUPAC Name: [4-(4-octylcyclohexyl)cyclohexyl] 3-fluoro-4-heptoxybenzoate Traditional Name: 3-fluoro-4-heptoxy-benzoic acid [4-(4-octylcyclohexyl)cyclohexyl] ester Formula: C34H55FO3 MolecularWeight: 530.797103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC(=C(C=C3)OCCCCCCC)F

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2CCC(CC2)OC(=O)C3=CC(=C(C=C3)OCCCCCCC)F

InChI

InChI=1S/C34H55FO3/c1-3-5-7-9-10-12-14-27-15-17-28(18-16-27)29-19-22-31(23-20-29)38-34(36)30-21-24-33(32(35)26-30)37-25-13-11-8-6-4-2/h21,24,26-29,31H,3-20,22-23,25H2,1-2H3