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

Systemtic Name: [2,3-bis(fluoranyl)-4-pentyl-phenyl] 4-octylcyclohexane-1-carboxylate Openeye Name: (2,3-difluoro-4-pentyl-phenyl) 4-octylcyclohexanecarboxylate CAS Name: 4-octyl-1-cyclohexanecarboxylic acid (2,3-difluoro-4-pentylphenyl) ester IUPAC Name: (2,3-difluoro-4-pentylphenyl) 4-octylcyclohexane-1-carboxylate Traditional Name: 4-octylcyclohexanecarboxylic acid (4-amyl-2,3-difluoro-phenyl) ester Formula: C26H40F2O2 MolecularWeight: 422.591406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)CCCCC)F)F

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)CCCCC)F)F

InChI

InChI=1S/C26H40F2O2/c1-3-5-7-8-9-11-12-20-14-16-22(17-15-20)26(29)30-23-19-18-21(13-10-6-4-2)24(27)25(23)28/h18-20,22H,3-17H2,1-2H3