(2-fluoranyl-4-hexyl-phenyl) 4-(4-pentylphenyl)benzoate

Systemtic Name: (2-fluoranyl-4-hexyl-phenyl) 4-(4-pentylphenyl)benzoate Openeye Name: (2-fluoro-4-hexyl-phenyl) 4-(4-pentylphenyl)benzoate CAS Name: 4-(4-pentylphenyl)benzoic acid (2-fluoro-4-hexylphenyl) ester IUPAC Name: (2-fluoro-4-hexylphenyl) 4-(4-pentylphenyl)benzoate Traditional Name: 4-(4-amylphenyl)benzoic acid (2-fluoro-4-hexyl-phenyl) ester Formula: C30H35FO2 MolecularWeight: 446.596103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H35FO2/c1-3-5-7-9-11-24-14-21-29(28(31)22-24)33-30(32)27-19-17-26(18-20-27)25-15-12-23(13-16-25)10-8-6-4-2/h12-22H,3-11H2,1-2H3