2-(2,4,6-trimethylphenyl)carbonylbutanenitrile

Systemtic Name: 2-(2,4,6-trimethylphenyl)carbonylbutanenitrile Openeye Name: 2-(2,4,6-trimethylbenzoyl)butanenitrile CAS Name: 2-[oxo-(2,4,6-trimethylphenyl)methyl]butanenitrile IUPAC Name: 2-(2,4,6-trimethylbenzoyl)butanenitrile Traditional Name: 2-(2,4,6-trimethylbenzoyl)butyronitrile Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)C(=O)C1=C(C=C(C=C1C)C)C

Isomeric SMILES

CCC(C#N)C(=O)C1=C(C=C(C=C1C)C)C

InChI

InChI=1S/C14H17NO/c1-5-12(8-15)14(16)13-10(3)6-9(2)7-11(13)4/h6-7,12H,5H2,1-4H3