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

Systemtic Name: [4-ethoxy-2,3-bis(fluoranyl)phenyl] 4-(4-heptylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (4-ethoxy-2,3-difluoro-phenyl) 4-(4-heptylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-heptylcyclohexyl)-1-cyclohexanecarboxylic acid (4-ethoxy-2,3-difluorophenyl) ester IUPAC Name: (4-ethoxy-2,3-difluorophenyl) 4-(4-heptylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-heptylcyclohexyl)cyclohexanecarboxylic acid (4-ethoxy-2,3-difluoro-phenyl) ester Formula: C28H42F2O3 MolecularWeight: 464.628086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCC)F)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCC)F)F

InChI

InChI=1S/C28H42F2O3/c1-3-5-6-7-8-9-20-10-12-21(13-11-20)22-14-16-23(17-15-22)28(31)33-25-19-18-24(32-4-2)26(29)27(25)30/h18-23H,3-17H2,1-2H3