2-[2-(cyanomethyl)-4,5-dimethyl-phenyl]ethanenitrile

Systemtic Name: 2-[2-(cyanomethyl)-4,5-dimethyl-phenyl]ethanenitrile Openeye Name: 2-[2-(cyanomethyl)-4,5-dimethyl-phenyl]acetonitrile CAS Name: 2-[2-(cyanomethyl)-4,5-dimethylphenyl]acetonitrile IUPAC Name: 2-[2-(cyanomethyl)-4,5-dimethylphenyl]acetonitrile Traditional Name: 2-[2-(cyanomethyl)-4,5-dimethyl-phenyl]acetonitrile Formula: C12H12N2 MolecularWeight: 184.23708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)CC#N)CC#N

Isomeric SMILES

CC1=CC(=C(C=C1C)CC#N)CC#N

InChI

InChI=1S/C12H12N2/c1-9-7-11(3-5-13)12(4-6-14)8-10(9)2/h7-8H,3-4H2,1-2H3