4-(2,4-dimethoxyphenyl)-4-oxidanylidene-butanenitrile

Systemtic Name: 4-(2,4-dimethoxyphenyl)-4-oxidanylidene-butanenitrile Openeye Name: 4-(2,4-dimethoxyphenyl)-4-oxo-butanenitrile CAS Name: 4-(2,4-dimethoxyphenyl)-4-oxobutanenitrile IUPAC Name: 4-(2,4-dimethoxyphenyl)-4-oxobutanenitrile Traditional Name: 4-(2,4-dimethoxyphenyl)-4-keto-butyronitrile Formula: C12H13NO3 MolecularWeight: 219.23652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)CCC#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)CCC#N)OC

InChI

InChI=1S/C12H13NO3/c1-15-9-5-6-10(12(8-9)16-2)11(14)4-3-7-13/h5-6,8H,3-4H2,1-2H3