3-bromanyl-2-phenyl-propanenitrile; 1,2-oxazirene

Systemtic Name: 3-bromanyl-2-phenyl-propanenitrile; 1,2-oxazirene Openeye Name: 3-bromo-2-phenyl-propanenitrile; oxazirene CAS Name: 3-bromo-2-phenylpropanenitrile; oxazirine IUPAC Name: 3-bromo-2-phenylpropanenitrile; oxazirene Traditional Name: 3-bromo-2-phenyl-propionitrile; oxazirine Formula: C10H9BrN2O MolecularWeight: 253.09526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CBr)C#N.C1=NO1

Isomeric SMILES

C1=CC=C(C=C1)C(CBr)C#N.C1=NO1

InChI

InChI=1S/C9H8BrN.CHNO/c10-6-9(7-11)8-4-2-1-3-5-8;1-2-3-1/h1-5,9H,6H2;1H