[4-(4-pentylphenyl)phenyl] 3-fluoranyl-4-(4-hexylphenyl)benzoate

Systemtic Name: [4-(4-pentylphenyl)phenyl] 3-fluoranyl-4-(4-hexylphenyl)benzoate Openeye Name: [4-(4-pentylphenyl)phenyl] 3-fluoro-4-(4-hexylphenyl)benzoate CAS Name: 3-fluoro-4-(4-hexylphenyl)benzoic acid [4-(4-pentylphenyl)phenyl] ester IUPAC Name: [4-(4-pentylphenyl)phenyl] 3-fluoro-4-(4-hexylphenyl)benzoate Traditional Name: 3-fluoro-4-(4-hexylphenyl)benzoic acid [4-(4-amylphenyl)phenyl] ester Formula: C36H39FO2 MolecularWeight: 522.692063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)CCCCC)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)CCCCC)F

InChI

InChI=1S/C36H39FO2/c1-3-5-7-9-11-28-14-18-31(19-15-28)34-25-22-32(26-35(34)37)36(38)39-33-23-20-30(21-24-33)29-16-12-27(13-17-29)10-8-6-4-2/h12-26H,3-11H2,1-2H3