[2,3-bis(fluoranyl)-4-pentyl-phenyl] 4-(4-hexylcyclohexyl)cyclohexane-1-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)CCCCC)F)F

Isomeric SMILES

CCCCCCC1CCC(CC1)C2CCC(CC2)C(=O)OC3=C(C(=C(C=C3)CCCCC)F)F

InChI

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