4-[(2,5-dimethoxyphenyl)-methyl-amino]butanenitrile

Systemtic Name: 4-[(2,5-dimethoxyphenyl)-methyl-amino]butanenitrile Openeye Name: 4-(2,5-dimethoxy-N-methyl-anilino)butanenitrile CAS Name: 4-(2,5-dimethoxy-N-methylanilino)butanenitrile IUPAC Name: 4-(2,5-dimethoxy-N-methylanilino)butanenitrile Traditional Name: 4-(2,5-dimethoxy-N-methyl-anilino)butyronitrile Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC#N)C1=C(C=CC(=C1)OC)OC

Isomeric SMILES

CN(CCCC#N)C1=C(C=CC(=C1)OC)OC

InChI

InChI=1S/C13H18N2O2/c1-15(9-5-4-8-14)12-10-11(16-2)6-7-13(12)17-3/h6-7,10H,4-5,9H2,1-3H3