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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C1(CCCCC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCC)F)F

Isomeric SMILES

CCCC(CCC)C1(CCCCC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)OCC)F)F

InChI

InChI=1S/C28H42F2O3/c1-4-10-21(11-5-2)28(18-8-7-9-19-28)22-14-12-20(13-15-22)27(31)33-24-17-16-23(32-6-3)25(29)26(24)30/h16-17,20-22H,4-15,18-19H2,1-3H3