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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H44F2O3/c1-3-5-6-7-8-9-21-10-12-22(13-11-21)23-14-16-24(17-15-23)29(32)34-26-19-18-25(33-20-4-2)27(30)28(26)31/h18-19,21-24H,3-17,20H2,1-2H3