(2-bromanyl-4-cyano-6-iodanyl-phenyl) butanoate

Systemtic Name: (2-bromanyl-4-cyano-6-iodanyl-phenyl) butanoate Openeye Name: (2-bromo-4-cyano-6-iodo-phenyl) butanoate CAS Name: butanoic acid (2-bromo-4-cyano-6-iodophenyl) ester IUPAC Name: (2-bromo-4-cyano-6-iodophenyl) butanoate Traditional Name: butyric acid (2-bromo-4-cyano-6-iodo-phenyl) ester Formula: C11H9BrINO2 MolecularWeight: 394.00313

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C(C=C1I)C#N)Br

Isomeric SMILES

CCCC(=O)OC1=C(C=C(C=C1I)C#N)Br

InChI

InChI=1S/C11H9BrINO2/c1-2-3-10(15)16-11-8(12)4-7(6-14)5-9(11)13/h4-5H,2-3H2,1H3