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

Systemtic Name: hexyl 4-(2-fluoranyl-4-propyl-phenyl)benzoate Openeye Name: hexyl 4-(2-fluoro-4-propyl-phenyl)benzoate CAS Name: 4-(2-fluoro-4-propylphenyl)benzoic acid hexyl ester IUPAC Name: hexyl 4-(2-fluoro-4-propylphenyl)benzoate Traditional Name: 4-(2-fluoro-4-propyl-phenyl)benzoic acid hexyl ester Formula: C22H27FO2 MolecularWeight: 342.446983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)CCC)F

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)CCC)F

InChI

InChI=1S/C22H27FO2/c1-3-5-6-7-15-25-22(24)19-12-10-18(11-13-19)20-14-9-17(8-4-2)16-21(20)23/h9-14,16H,3-8,15H2,1-2H3