5-(bromomethyl)-2-methylsulfonyl-benzenecarbonitrile

Systemtic Name: 5-(bromomethyl)-2-methylsulfonyl-benzenecarbonitrile Openeye Name: 5-(bromomethyl)-2-methylsulfonyl-benzonitrile CAS Name: 5-(bromomethyl)-2-methylsulfonylbenzonitrile IUPAC Name: 5-(bromomethyl)-2-methylsulfonylbenzonitrile Traditional Name: 5-(bromomethyl)-2-mesyl-benzonitrile Formula: C9H8BrNO2S MolecularWeight: 274.13432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)CBr)C#N

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)CBr)C#N

InChI

InChI=1S/C9H8BrNO2S/c1-14(12,13)9-3-2-7(5-10)4-8(9)6-11/h2-4H,5H2,1H3