2-(3-bromanyl-4-iodanyl-phenyl)ethanenitrile

Systemtic Name: 2-(3-bromanyl-4-iodanyl-phenyl)ethanenitrile Openeye Name: 2-(3-bromo-4-iodo-phenyl)acetonitrile CAS Name: 2-(3-bromo-4-iodophenyl)acetonitrile IUPAC Name: 2-(3-bromo-4-iodophenyl)acetonitrile Traditional Name: 2-(3-bromo-4-iodo-phenyl)acetonitrile Formula: C8H5BrIN MolecularWeight: 321.94047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC#N)Br)I

Isomeric SMILES

C1=CC(=C(C=C1CC#N)Br)I

InChI

InChI=1S/C8H5BrIN/c9-7-5-6(3-4-11)1-2-8(7)10/h1-2,5H,3H2