[2,3-bis(fluoranyl)-4-(4-octylcyclohexyl)carbonyloxy-phenyl] 4-octylcyclohexane-1-carboxylate

Systemtic Name: [2,3-bis(fluoranyl)-4-(4-octylcyclohexyl)carbonyloxy-phenyl] 4-octylcyclohexane-1-carboxylate Openeye Name: [2,3-difluoro-4-(4-octylcyclohexanecarbonyl)oxy-phenyl] 4-octylcyclohexanecarboxylate CAS Name: 4-octyl-1-cyclohexanecarboxylic acid [2,3-difluoro-4-[(4-octylcyclohexyl)-oxomethoxy]phenyl] ester IUPAC Name: [2,3-difluoro-4-(4-octylcyclohexanecarbonyl)oxyphenyl] 4-octylcyclohexane-1-carboxylate Traditional Name: 4-octylcyclohexanecarboxylic acid [2,3-difluoro-4-(4-octylcyclohexanecarbonyl)oxy-phenyl] ester Formula: C36H56F2O4 MolecularWeight: 590.824246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)OC(=O)C3CCC(CC3)CCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)OC(=O)C3CCC(CC3)CCCCCCCC)F)F

InChI

InChI=1S/C36H56F2O4/c1-3-5-7-9-11-13-15-27-17-21-29(22-18-27)35(39)41-31-25-26-32(34(38)33(31)37)42-36(40)30-23-19-28(20-24-30)16-14-12-10-8-6-4-2/h25-30H,3-24H2,1-2H3