4-[(3,4-dimethoxyphenyl)methylamino]butanenitrile

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methylamino]butanenitrile Openeye Name: 4-[(3,4-dimethoxyphenyl)methylamino]butanenitrile CAS Name: 4-[(3,4-dimethoxyphenyl)methylamino]butanenitrile IUPAC Name: 4-[(3,4-dimethoxyphenyl)methylamino]butanenitrile Traditional Name: 4-(veratrylamino)butyronitrile Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNCCCC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNCCCC#N)OC

InChI

InChI=1S/C13H18N2O2/c1-16-12-6-5-11(9-13(12)17-2)10-15-8-4-3-7-14/h5-6,9,15H,3-4,8,10H2,1-2H3