2-[3-(bromomethyl)-5-methyl-phenyl]-2-methyl-propanenitrile

Systemtic Name: 2-[3-(bromomethyl)-5-methyl-phenyl]-2-methyl-propanenitrile Openeye Name: 2-[3-(bromomethyl)-5-methyl-phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(bromomethyl)-5-methylphenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(bromomethyl)-5-methylphenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(bromomethyl)-5-methyl-phenyl]-2-methyl-propionitrile Formula: C12H14BrN MolecularWeight: 252.15026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(C)(C)C#N)CBr

Isomeric SMILES

CC1=CC(=CC(=C1)C(C)(C)C#N)CBr

InChI

InChI=1S/C12H14BrN/c1-9-4-10(7-13)6-11(5-9)12(2,3)8-14/h4-6H,7H2,1-3H3