[2,3-bis(fluoranyl)-4-octoxy-phenyl] 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate

Systemtic Name: [2,3-bis(fluoranyl)-4-octoxy-phenyl] 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (2,3-difluoro-4-octoxy-phenyl) 4-(4-propylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-propylcyclohexyl)-1-cyclohexanecarboxylic acid (2,3-difluoro-4-octoxyphenyl) ester IUPAC Name: (2,3-difluoro-4-octoxyphenyl) 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-propylcyclohexyl)cyclohexanecarboxylic acid (2,3-difluoro-4-octoxy-phenyl) ester Formula: C30H46F2O3 MolecularWeight: 492.681246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCC)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCC)F)F

InChI

InChI=1S/C30H46F2O3/c1-3-5-6-7-8-9-21-34-26-19-20-27(29(32)28(26)31)35-30(33)25-17-15-24(16-18-25)23-13-11-22(10-4-2)12-14-23/h19-20,22-25H,3-18,21H2,1-2H3