[4-(4-pentylcyclohexyl)cyclohexyl] 2,3-bis(fluoranyl)-4-octoxy-benzoate

Systemtic Name: [4-(4-pentylcyclohexyl)cyclohexyl] 2,3-bis(fluoranyl)-4-octoxy-benzoate Openeye Name: [4-(4-pentylcyclohexyl)cyclohexyl] 2,3-difluoro-4-octoxy-benzoate CAS Name: 2,3-difluoro-4-octoxybenzoic acid [4-(4-pentylcyclohexyl)cyclohexyl] ester IUPAC Name: [4-(4-pentylcyclohexyl)cyclohexyl] 2,3-difluoro-4-octoxybenzoate Traditional Name: 2,3-difluoro-4-octoxy-benzoic acid [4-(4-amylcyclohexyl)cyclohexyl] ester Formula: C32H50F2O3 MolecularWeight: 520.734406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)C(=O)OC2CCC(CC2)C3CCC(CC3)CCCCC)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)C(=O)OC2CCC(CC2)C3CCC(CC3)CCCCC)F)F

InChI

InChI=1S/C32H50F2O3/c1-3-5-7-8-9-11-23-36-29-22-21-28(30(33)31(29)34)32(35)37-27-19-17-26(18-20-27)25-15-13-24(14-16-25)12-10-6-4-2/h21-22,24-27H,3-20,23H2,1-2H3