2-[2-(cyanomethyl)-4-methyl-phenyl]ethanenitrile

Systemtic Name: 2-[2-(cyanomethyl)-4-methyl-phenyl]ethanenitrile Openeye Name: 2-[2-(cyanomethyl)-4-methyl-phenyl]acetonitrile CAS Name: 2-[2-(cyanomethyl)-4-methylphenyl]acetonitrile IUPAC Name: 2-[2-(cyanomethyl)-4-methylphenyl]acetonitrile Traditional Name: 2-[2-(cyanomethyl)-4-methyl-phenyl]acetonitrile Formula: C11H10N2 MolecularWeight: 170.2105

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N2/c1-9-2-3-10(4-6-12)11(8-9)5-7-13/h2-3,8H,4-5H2,1H3