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

Systemtic Name: (4-octylphenyl) 2,3-bis(fluoranyl)-4-octoxy-benzoate Openeye Name: (4-octylphenyl) 2,3-difluoro-4-octoxy-benzoate CAS Name: 2,3-difluoro-4-octoxybenzoic acid (4-octylphenyl) ester IUPAC Name: (4-octylphenyl) 2,3-difluoro-4-octoxybenzoate Traditional Name: 2,3-difluoro-4-octoxy-benzoic acid (4-octylphenyl) ester Formula: C29H40F2O3 MolecularWeight: 474.622906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)OCCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)OCCCCCCCC)F)F

InChI

InChI=1S/C29H40F2O3/c1-3-5-7-9-11-13-15-23-16-18-24(19-17-23)34-29(32)25-20-21-26(28(31)27(25)30)33-22-14-12-10-8-6-4-2/h16-21H,3-15,22H2,1-2H3