(4-propylphenyl) 2,3-bis(fluoranyl)-4-(3-fluoranyl-4-pentyl-phenyl)benzoate

Systemtic Name: (4-propylphenyl) 2,3-bis(fluoranyl)-4-(3-fluoranyl-4-pentyl-phenyl)benzoate Openeye Name: (4-propylphenyl) 2,3-difluoro-4-(3-fluoro-4-pentyl-phenyl)benzoate CAS Name: 2,3-difluoro-4-(3-fluoro-4-pentylphenyl)benzoic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 2,3-difluoro-4-(3-fluoro-4-pentylphenyl)benzoate Traditional Name: 4-(4-amyl-3-fluoro-phenyl)-2,3-difluoro-benzoic acid (4-propylphenyl) ester Formula: C27H27F3O2 MolecularWeight: 440.49729

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(C=C1)C2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC)F)F)F

Isomeric SMILES

CCCCCC1=C(C=C(C=C1)C2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCC)F)F)F

InChI

InChI=1S/C27H27F3O2/c1-3-5-6-8-19-11-12-20(17-24(19)28)22-15-16-23(26(30)25(22)29)27(31)32-21-13-9-18(7-4-2)10-14-21/h9-17H,3-8H2,1-2H3