2-(3,4-dimethoxyphenyl)-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-4,4-dimethyl-3-oxopentanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-3-keto-4,4-dimethyl-valeronitrile Formula: C15H19NO3 MolecularWeight: 261.31626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3/c1-15(2,3)14(17)11(9-16)10-6-7-12(18-4)13(8-10)19-5/h6-8,11H,1-5H3