6-cyclohexylhexan-3-yl 2,3-bis(fluoranyl)-4-[2-(4-pentylcyclohexyl)ethyl]benzoate

Systemtic Name: 6-cyclohexylhexan-3-yl 2,3-bis(fluoranyl)-4-[2-(4-pentylcyclohexyl)ethyl]benzoate Openeye Name: (4-cyclohexyl-1-ethyl-butyl) 2,3-difluoro-4-[2-(4-pentylcyclohexyl)ethyl]benzoate CAS Name: 2,3-difluoro-4-[2-(4-pentylcyclohexyl)ethyl]benzoic acid 6-cyclohexylhexan-3-yl ester IUPAC Name: 6-cyclohexylhexan-3-yl 2,3-difluoro-4-[2-(4-pentylcyclohexyl)ethyl]benzoate Traditional Name: 4-[2-(4-amylcyclohexyl)ethyl]-2,3-difluoro-benzoic acid (4-cyclohexyl-1-ethyl-butyl) ester Formula: C32H50F2O2 MolecularWeight: 504.735006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC2=C(C(=C(C=C2)C(=O)OC(CC)CCCC3CCCCC3)F)F

Isomeric SMILES

CCCCCC1CCC(CC1)CCC2=C(C(=C(C=C2)C(=O)OC(CC)CCCC3CCCCC3)F)F

InChI

InChI=1S/C32H50F2O2/c1-3-5-7-11-25-16-18-26(19-17-25)20-21-27-22-23-29(31(34)30(27)33)32(35)36-28(4-2)15-10-14-24-12-8-6-9-13-24/h22-26,28H,3-21H2,1-2H3