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

Systemtic Name: [4-ethoxy-2,3-bis(fluoranyl)phenyl] 4-(4-hexylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-ethoxy-2,3-difluoro-phenyl) 4-(4-hexylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-hexylcyclohexyl)-1-cyclohexanecarboxylic acid (4-ethoxy-2,3-difluorophenyl) ester IUPAC Name: (4-ethoxy-2,3-difluorophenyl) 4-(4-hexylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-hexylcyclohexyl)cyclohexanecarboxylic acid (4-ethoxy-2,3-difluoro-phenyl) ester Formula: C27H40F2O3 MolecularWeight: 450.601506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCC)F)F

Isomeric SMILES

CCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCC)F)F

InChI

InChI=1S/C27H40F2O3/c1-3-5-6-7-8-19-9-11-20(12-10-19)21-13-15-22(16-14-21)27(30)32-24-18-17-23(31-4-2)25(28)26(24)29/h17-22H,3-16H2,1-2H3