(2-bromanyl-4-fluoranyl-phenyl) 4-butylbenzoate

Systemtic Name: (2-bromanyl-4-fluoranyl-phenyl) 4-butylbenzoate Openeye Name: (2-bromo-4-fluoro-phenyl) 4-butylbenzoate CAS Name: 4-butylbenzoic acid (2-bromo-4-fluorophenyl) ester IUPAC Name: (2-bromo-4-fluorophenyl) 4-butylbenzoate Traditional Name: 4-butylbenzoic acid (2-bromo-4-fluoro-phenyl) ester Formula: C17H16BrFO2 MolecularWeight: 351.210143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)F)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C17H16BrFO2/c1-2-3-4-12-5-7-13(8-6-12)17(20)21-16-10-9-14(19)11-15(16)18/h5-11H,2-4H2,1H3