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

Systemtic Name: (2E)-2-[(2-chlorophenyl)methylidene]-4,4-dimethyl-3-oxidanylidene-pentanenitrile Openeye Name: (2E)-2-[(2-chlorophenyl)methylene]-4,4-dimethyl-3-oxo-pentanenitrile CAS Name: (2E)-2-[(2-chlorophenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile IUPAC Name: (2E)-2-[(2-chlorophenyl)methylidene]-4,4-dimethyl-3-oxopentanenitrile Traditional Name: (E)-3-(2-chlorophenyl)-2-pivaloyl-acrylonitrile Formula: C14H14ClNO MolecularWeight: 247.72006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC=CC=C1Cl)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CC=CC=C1Cl)/C#N

InChI

InChI=1S/C14H14ClNO/c1-14(2,3)13(17)11(9-16)8-10-6-4-5-7-12(10)15/h4-8H,1-3H3/b11-8+