2-chloranyl-2-[4-(2,2-dimethylpropanoyl)phenyl]ethanenitrile

Systemtic Name: 2-chloranyl-2-[4-(2,2-dimethylpropanoyl)phenyl]ethanenitrile Openeye Name: 2-chloro-2-[4-(2,2-dimethylpropanoyl)phenyl]acetonitrile CAS Name: 2-chloro-2-[4-(2,2-dimethyl-1-oxopropyl)phenyl]acetonitrile IUPAC Name: 2-chloro-2-[4-(2,2-dimethylpropanoyl)phenyl]acetonitrile Traditional Name: 2-chloro-2-(4-pivaloylphenyl)acetonitrile Formula: C13H14ClNO MolecularWeight: 235.70936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C1=CC=C(C=C1)C(C#N)Cl

Isomeric SMILES

CC(C)(C)C(=O)C1=CC=C(C=C1)C(C#N)Cl

InChI

InChI=1S/C13H14ClNO/c1-13(2,3)12(16)10-6-4-9(5-7-10)11(14)8-15/h4-7,11H,1-3H3