ethyl 4-(4-butyl-2-fluoranyl-phenyl)benzoate

Systemtic Name: ethyl 4-(4-butyl-2-fluoranyl-phenyl)benzoate Openeye Name: ethyl 4-(4-butyl-2-fluoro-phenyl)benzoate CAS Name: 4-(4-butyl-2-fluorophenyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-butyl-2-fluorophenyl)benzoate Traditional Name: 4-(4-butyl-2-fluoro-phenyl)benzoic acid ethyl ester Formula: C19H21FO2 MolecularWeight: 300.367243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)C(=O)OCC)F

Isomeric SMILES

CCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)C(=O)OCC)F

InChI

InChI=1S/C19H21FO2/c1-3-5-6-14-7-12-17(18(20)13-14)15-8-10-16(11-9-15)19(21)22-4-2/h7-13H,3-6H2,1-2H3