[3,4,5-tris(fluoranyl)phenyl] 2-(4-hexylcyclohexyl)benzoate

Systemtic Name: [3,4,5-tris(fluoranyl)phenyl] 2-(4-hexylcyclohexyl)benzoate Openeye Name: (3,4,5-trifluorophenyl) 2-(4-hexylcyclohexyl)benzoate CAS Name: 2-(4-hexylcyclohexyl)benzoic acid (3,4,5-trifluorophenyl) ester IUPAC Name: (3,4,5-trifluorophenyl) 2-(4-hexylcyclohexyl)benzoate Traditional Name: 2-(4-hexylcyclohexyl)benzoic acid (3,4,5-trifluorophenyl) ester Formula: C25H29F3O2 MolecularWeight: 418.49177

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2=CC=CC=C2C(=O)OC3=CC(=C(C(=C3)F)F)F

Isomeric SMILES

CCCCCCC1CCC(CC1)C2=CC=CC=C2C(=O)OC3=CC(=C(C(=C3)F)F)F

InChI

InChI=1S/C25H29F3O2/c1-2-3-4-5-8-17-11-13-18(14-12-17)20-9-6-7-10-21(20)25(29)30-19-15-22(26)24(28)23(27)16-19/h6-7,9-10,15-18H,2-5,8,11-14H2,1H3