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

Systemtic Name: (4-undecylphenyl) 2,3-bis(fluoranyl)-4-nonyl-benzoate Openeye Name: (4-undecylphenyl) 2,3-difluoro-4-nonyl-benzoate CAS Name: 2,3-difluoro-4-nonylbenzoic acid (4-undecylphenyl) ester IUPAC Name: (4-undecylphenyl) 2,3-difluoro-4-nonylbenzoate Traditional Name: 2,3-difluoro-4-nonyl-benzoic acid (4-undecylphenyl) ester Formula: C33H48F2O2 MolecularWeight: 514.729826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)CCCCCCCCC)F)F

Isomeric SMILES

CCCCCCCCCCCC1=CC=C(C=C1)OC(=O)C2=C(C(=C(C=C2)CCCCCCCCC)F)F

InChI

InChI=1S/C33H48F2O2/c1-3-5-7-9-11-12-14-15-17-19-27-21-24-29(25-22-27)37-33(36)30-26-23-28(31(34)32(30)35)20-18-16-13-10-8-6-4-2/h21-26H,3-20H2,1-2H3