2-[(2-bromophenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-[(2-bromophenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: 2-[(2-bromophenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: 2-[(2-bromophenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: 2-[(2-bromophenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: 3-(2-bromophenyl)-2-pivaloyl-acrylonitrile Formula: C14H14BrNO MolecularWeight: 292.17106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14BrNO/c1-14(2,3)13(17)11(9-16)8-10-6-4-5-7-12(10)15/h4-8H,1-3H3