(2-fluoranyl-4-pentyl-phenyl) 4-(4-methylphenyl)benzoate

Systemtic Name: (2-fluoranyl-4-pentyl-phenyl) 4-(4-methylphenyl)benzoate Openeye Name: (2-fluoro-4-pentyl-phenyl) 4-(p-tolyl)benzoate CAS Name: 4-(4-methylphenyl)benzoic acid (2-fluoro-4-pentylphenyl) ester IUPAC Name: (2-fluoro-4-pentylphenyl) 4-(4-methylphenyl)benzoate Traditional Name: 4-(p-tolyl)benzoic acid (4-amyl-2-fluoro-phenyl) ester Formula: C25H25FO2 MolecularWeight: 376.463203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C)F

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C)F

InChI

InChI=1S/C25H25FO2/c1-3-4-5-6-19-9-16-24(23(26)17-19)28-25(27)22-14-12-21(13-15-22)20-10-7-18(2)8-11-20/h7-17H,3-6H2,1-2H3