(2E)-2-[(2,5-dimethylphenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-[(2,5-dimethylphenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[(2,5-dimethylphenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[(2,5-dimethylphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[(2,5-dimethylphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (E)-3-(2,5-dimethylphenyl)-2-pivaloyl-acrylonitrile Formula: C16H19NO MolecularWeight: 241.32816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=C(C#N)C(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=C(\C#N)/C(=O)C(C)(C)C

InChI

InChI=1S/C16H19NO/c1-11-6-7-12(2)13(8-11)9-14(10-17)15(18)16(3,4)5/h6-9H,1-5H3/b14-9+