[4-ethoxy-2,3-bis(fluoranyl)phenyl] 4-(4-octylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: [4-ethoxy-2,3-bis(fluoranyl)phenyl] 4-(4-octylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-ethoxy-2,3-difluoro-phenyl) 4-(4-octylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-octylcyclohexyl)-1-cyclohexanecarboxylic acid (4-ethoxy-2,3-difluorophenyl) ester IUPAC Name: (4-ethoxy-2,3-difluorophenyl) 4-(4-octylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-octylcyclohexyl)cyclohexanecarboxylic acid (4-ethoxy-2,3-difluoro-phenyl) ester Formula: C29H44F2O3 MolecularWeight: 478.654666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCC)F)F

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCC)F)F

InChI

InChI=1S/C29H44F2O3/c1-3-5-6-7-8-9-10-21-11-13-22(14-12-21)23-15-17-24(18-16-23)29(32)34-26-20-19-25(33-4-2)27(30)28(26)31/h19-24H,3-18H2,1-2H3