(2E)-2-[(3-ethoxy-4-methoxy-phenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-[(3-ethoxy-4-methoxy-phenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[(3-ethoxy-4-methoxy-phenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[(3-ethoxy-4-methoxyphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[(3-ethoxy-4-methoxyphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (E)-3-(3-ethoxy-4-methoxy-phenyl)-2-pivaloyl-acrylonitrile Formula: C17H21NO3 MolecularWeight: 287.35354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)C(C)(C)C)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)C(C)(C)C)OC

InChI

InChI=1S/C17H21NO3/c1-6-21-15-10-12(7-8-14(15)20-5)9-13(11-18)16(19)17(2,3)4/h7-10H,6H2,1-5H3/b13-9+