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

Systemtic Name: (4-pentylphenyl) 2,3-bis(fluoranyl)-4-(4-undecoxyphenyl)benzoate Openeye Name: (4-pentylphenyl) 2,3-difluoro-4-(4-undecoxyphenyl)benzoate CAS Name: 2,3-difluoro-4-(4-undecoxyphenyl)benzoic acid (4-pentylphenyl) ester IUPAC Name: (4-pentylphenyl) 2,3-difluoro-4-(4-undecoxyphenyl)benzoate Traditional Name: 2,3-difluoro-4-(4-undecoxyphenyl)benzoic acid (4-amylphenyl) ester Formula: C35H44F2O3 MolecularWeight: 550.718866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC)F)F

Isomeric SMILES

CCCCCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCCC)F)F

InChI

InChI=1S/C35H44F2O3/c1-3-5-7-8-9-10-11-12-14-26-39-29-22-18-28(19-23-29)31-24-25-32(34(37)33(31)36)35(38)40-30-20-16-27(17-21-30)15-13-6-4-2/h16-25H,3-15,26H2,1-2H3