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

Systemtic Name: 2-[4-(2,2-dimethylpropanoyl)phenyl]ethanenitrile Openeye Name: 2-[4-(2,2-dimethylpropanoyl)phenyl]acetonitrile CAS Name: 2-[4-(2,2-dimethyl-1-oxopropyl)phenyl]acetonitrile IUPAC Name: 2-[4-(2,2-dimethylpropanoyl)phenyl]acetonitrile Traditional Name: 2-(4-pivaloylphenyl)acetonitrile Formula: C13H15NO MolecularWeight: 201.2643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO/c1-13(2,3)12(15)11-6-4-10(5-7-11)8-9-14/h4-7H,8H2,1-3H3