3-[(2,4-dimethylphenyl)methylamino]propanenitrile

Systemtic Name: 3-[(2,4-dimethylphenyl)methylamino]propanenitrile Openeye Name: 3-[(2,4-dimethylphenyl)methylamino]propanenitrile CAS Name: 3-[(2,4-dimethylphenyl)methylamino]propanenitrile IUPAC Name: 3-[(2,4-dimethylphenyl)methylamino]propanenitrile Traditional Name: 3-[(2,4-dimethylbenzyl)amino]propionitrile Formula: C12H16N2 MolecularWeight: 188.26884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2/c1-10-4-5-12(11(2)8-10)9-14-7-3-6-13/h4-5,8,14H,3,7,9H2,1-2H3