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

Systemtic Name: (2E)-4,4-dimethyl-2-[(4-nitrophenyl)methylidene]-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-4,4-dimethyl-2-[(4-nitrophenyl)methylene]-3-oxo-pentanenitrile CAS Name: (2E)-4,4-dimethyl-2-[(4-nitrophenyl)methylidene]-3-oxopentanenitrile IUPAC Name: (2E)-4,4-dimethyl-2-[(4-nitrophenyl)methylidene]-3-oxopentanenitrile Traditional Name: (E)-3-(4-nitrophenyl)-2-pivaloyl-acrylonitrile Formula: C14H14N2O3 MolecularWeight: 258.27256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CC=C(C=C1)[N+](=O)[O-])/C#N

InChI

InChI=1S/C14H14N2O3/c1-14(2,3)13(17)11(9-15)8-10-4-6-12(7-5-10)16(18)19/h4-8H,1-3H3/b11-8+