2-[(4-methoxy-2,5-dimethyl-phenyl)methyl]propanedinitrile

Systemtic Name: 2-[(4-methoxy-2,5-dimethyl-phenyl)methyl]propanedinitrile Openeye Name: 2-[(4-methoxy-2,5-dimethyl-phenyl)methyl]propanedinitrile CAS Name: 2-[(4-methoxy-2,5-dimethylphenyl)methyl]propanedinitrile IUPAC Name: 2-[(4-methoxy-2,5-dimethylphenyl)methyl]propanedinitrile Traditional Name: 2-(4-methoxy-2,5-dimethyl-benzyl)malononitrile Formula: C13H14N2O MolecularWeight: 214.26306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CC(C#N)C#N)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CC(C#N)C#N)C)OC

InChI

InChI=1S/C13H14N2O/c1-9-5-13(16-3)10(2)4-12(9)6-11(7-14)8-15/h4-5,11H,6H2,1-3H3