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

Systemtic Name: 4-[(3,4-dimethoxyphenyl)amino]butanenitrile Openeye Name: 4-(3,4-dimethoxyanilino)butanenitrile CAS Name: 4-(3,4-dimethoxyanilino)butanenitrile IUPAC Name: 4-(3,4-dimethoxyanilino)butanenitrile Traditional Name: 4-(3,4-dimethoxyanilino)butyronitrile Formula: C12H16N2O2 MolecularWeight: 220.26764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O2/c1-15-11-6-5-10(9-12(11)16-2)14-8-4-3-7-13/h5-6,9,14H,3-4,8H2,1-2H3