[2,3-bis(fluoranyl)-4-octyl-phenyl] 2-fluoranyl-4-heptyl-benzoate

Systemtic Name: [2,3-bis(fluoranyl)-4-octyl-phenyl] 2-fluoranyl-4-heptyl-benzoate Openeye Name: (2,3-difluoro-4-octyl-phenyl) 2-fluoro-4-heptyl-benzoate CAS Name: 2-fluoro-4-heptylbenzoic acid (2,3-difluoro-4-octylphenyl) ester IUPAC Name: (2,3-difluoro-4-octylphenyl) 2-fluoro-4-heptylbenzoate Traditional Name: 2-fluoro-4-heptyl-benzoic acid (2,3-difluoro-4-octyl-phenyl) ester Formula: C28H37F3O2 MolecularWeight: 462.58739

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C=C1)OC(=O)C2=C(C=C(C=C2)CCCCCCC)F)F)F

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C=C1)OC(=O)C2=C(C=C(C=C2)CCCCCCC)F)F)F

InChI

InChI=1S/C28H37F3O2/c1-3-5-7-9-11-13-15-22-17-19-25(27(31)26(22)30)33-28(32)23-18-16-21(20-24(23)29)14-12-10-8-6-4-2/h16-20H,3-15H2,1-2H3