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

Systemtic Name: [2,3-bis(fluoranyl)-4-octyl-phenyl] 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate Openeye Name: (2,3-difluoro-4-octyl-phenyl) 4-(4-propylcyclohexyl)cyclohexanecarboxylate CAS Name: 4-(4-propylcyclohexyl)-1-cyclohexanecarboxylic acid (2,3-difluoro-4-octylphenyl) ester IUPAC Name: (2,3-difluoro-4-octylphenyl) 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-propylcyclohexyl)cyclohexanecarboxylic acid (2,3-difluoro-4-octyl-phenyl) ester Formula: C30H46F2O2 MolecularWeight: 476.681846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCC)F)F

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C=C1)OC(=O)C2CCC(CC2)C3CCC(CC3)CCC)F)F

InChI

InChI=1S/C30H46F2O2/c1-3-5-6-7-8-9-11-25-20-21-27(29(32)28(25)31)34-30(33)26-18-16-24(17-19-26)23-14-12-22(10-4-2)13-15-23/h20-24,26H,3-19H2,1-2H3