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

Systemtic Name: (4-pentylphenyl) 2,3-bis(fluoranyl)-4-nonyl-benzoate Openeye Name: (4-pentylphenyl) 2,3-difluoro-4-nonyl-benzoate CAS Name: 2,3-difluoro-4-nonylbenzoic acid (4-pentylphenyl) ester IUPAC Name: (4-pentylphenyl) 2,3-difluoro-4-nonylbenzoate Traditional Name: 2,3-difluoro-4-nonyl-benzoic acid (4-amylphenyl) ester Formula: C27H36F2O2 MolecularWeight: 430.570346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCCC)F)F

Isomeric SMILES

CCCCCCCCCC1=C(C(=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCCC)F)F

InChI

InChI=1S/C27H36F2O2/c1-3-5-7-8-9-10-12-14-22-17-20-24(26(29)25(22)28)27(30)31-23-18-15-21(16-19-23)13-11-6-4-2/h15-20H,3-14H2,1-2H3