(2E)-2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2E)-2-[(2-bromanyl-4,5-dimethoxy-phenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[(2-bromo-4,5-dimethoxy-phenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (E)-3-(2-bromo-4,5-dimethoxy-phenyl)-2-pivaloyl-acrylonitrile Formula: C16H18BrNO3 MolecularWeight: 352.22302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC(=C(C=C1Br)OC)OC)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CC(=C(C=C1Br)OC)OC)/C#N

InChI

InChI=1S/C16H18BrNO3/c1-16(2,3)15(19)11(9-18)6-10-7-13(20-4)14(21-5)8-12(10)17/h6-8H,1-5H3/b11-6+