(2Z)-2-[[1-(4-chlorophenyl)pyrazol-4-yl]methylidene]-4-methyl-3-oxidanylidene-pentanenitrile

Systemtic Name: (2Z)-2-[[1-(4-chlorophenyl)pyrazol-4-yl]methylidene]-4-methyl-3-oxidanylidene-pentanenitrile Openeye Name: (2Z)-2-[[1-(4-chlorophenyl)pyrazol-4-yl]methylene]-4-methyl-3-oxo-pentanenitrile CAS Name: (2Z)-2-[[1-(4-chlorophenyl)-4-pyrazolyl]methylidene]-4-methyl-3-oxopentanenitrile IUPAC Name: (2Z)-2-[[1-(4-chlorophenyl)pyrazol-4-yl]methylidene]-4-methyl-3-oxopentanenitrile Traditional Name: (Z)-3-[1-(4-chlorophenyl)pyrazol-4-yl]-2-isobutyryl-acrylonitrile Formula: C16H14ClN3O MolecularWeight: 299.75486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(=CC1=CN(N=C1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CC(C)C(=O)/C(=C\C1=CN(N=C1)C2=CC=C(C=C2)Cl)/C#N

InChI

InChI=1S/C16H14ClN3O/c1-11(2)16(21)13(8-18)7-12-9-19-20(10-12)15-5-3-14(17)4-6-15/h3-7,9-11H,1-2H3/b13-7-