3-[(3,5-dimethoxyphenyl)methylamino]propanenitrile

Systemtic Name: 3-[(3,5-dimethoxyphenyl)methylamino]propanenitrile Openeye Name: 3-[(3,5-dimethoxyphenyl)methylamino]propanenitrile CAS Name: 3-[(3,5-dimethoxyphenyl)methylamino]propanenitrile IUPAC Name: 3-[(3,5-dimethoxyphenyl)methylamino]propanenitrile Traditional Name: 3-[(3,5-dimethoxybenzyl)amino]propionitrile Formula: C12H16N2O2 MolecularWeight: 220.26764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNCCC#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNCCC#N)OC

InChI

InChI=1S/C12H16N2O2/c1-15-11-6-10(7-12(8-11)16-2)9-14-5-3-4-13/h6-8,14H,3,5,9H2,1-2H3