(4-hexylphenyl) 2,3-bis(fluoranyl)-4-octoxy-benzoate

Systemtic Name: (4-hexylphenyl) 2,3-bis(fluoranyl)-4-octoxy-benzoate Openeye Name: (4-hexylphenyl) 2,3-difluoro-4-octoxy-benzoate CAS Name: 2,3-difluoro-4-octoxybenzoic acid (4-hexylphenyl) ester IUPAC Name: (4-hexylphenyl) 2,3-difluoro-4-octoxybenzoate Traditional Name: 2,3-difluoro-4-octoxy-benzoic acid (4-hexylphenyl) ester Formula: C27H36F2O3 MolecularWeight: 446.569746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C(=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCCCC)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C(=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCCCC)F)F

InChI

InChI=1S/C27H36F2O3/c1-3-5-7-9-10-12-20-31-24-19-18-23(25(28)26(24)29)27(30)32-22-16-14-21(15-17-22)13-11-8-6-4-2/h14-19H,3-13,20H2,1-2H3