(4-pentylphenyl) 2,3-bis(fluoranyl)-4-(4-nonylcyclohexyl)benzoate

Systemtic Name: (4-pentylphenyl) 2,3-bis(fluoranyl)-4-(4-nonylcyclohexyl)benzoate Openeye Name: (4-pentylphenyl) 2,3-difluoro-4-(4-nonylcyclohexyl)benzoate CAS Name: 2,3-difluoro-4-(4-nonylcyclohexyl)benzoic acid (4-pentylphenyl) ester IUPAC Name: (4-pentylphenyl) 2,3-difluoro-4-(4-nonylcyclohexyl)benzoate Traditional Name: 2,3-difluoro-4-(4-nonylcyclohexyl)benzoic acid (4-amylphenyl) ester Formula: C33H46F2O2 MolecularWeight: 512.713946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC)F)F

Isomeric SMILES

CCCCCCCCCC1CCC(CC1)C2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC)F)F

InChI

InChI=1S/C33H46F2O2/c1-3-5-7-8-9-10-12-14-25-15-19-27(20-16-25)29-23-24-30(32(35)31(29)34)33(36)37-28-21-17-26(18-22-28)13-11-6-4-2/h17-18,21-25,27H,3-16,19-20H2,1-2H3