(2-iodanylphenyl) 2-bromanyl-4-cyano-octanoate

Systemtic Name: (2-iodanylphenyl) 2-bromanyl-4-cyano-octanoate Openeye Name: (2-iodophenyl) 2-bromo-4-cyano-octanoate CAS Name: 2-bromo-4-cyanooctanoic acid (2-iodophenyl) ester IUPAC Name: (2-iodophenyl) 2-bromo-4-cyanooctanoate Traditional Name: 2-bromo-4-cyano-caprylic acid (2-iodophenyl) ester Formula: C15H17BrINO2 MolecularWeight: 450.10945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C(=O)OC1=CC=CC=C1I)Br)C#N

Isomeric SMILES

CCCCC(CC(C(=O)OC1=CC=CC=C1I)Br)C#N

InChI

InChI=1S/C15H17BrINO2/c1-2-3-6-11(10-18)9-12(16)15(19)20-14-8-5-4-7-13(14)17/h4-5,7-8,11-12H,2-3,6,9H2,1H3