2-(4-propan-2-ylphenyl)carbonylbutanenitrile

Systemtic Name: 2-(4-propan-2-ylphenyl)carbonylbutanenitrile Openeye Name: 2-(4-isopropylbenzoyl)butanenitrile CAS Name: 2-[oxo-(4-propan-2-ylphenyl)methyl]butanenitrile IUPAC Name: 2-(4-propan-2-ylbenzoyl)butanenitrile Traditional Name: 2-cumoylbutyronitrile Formula: C14H17NO MolecularWeight: 215.29088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO/c1-4-11(9-15)14(16)13-7-5-12(6-8-13)10(2)3/h5-8,10-11H,4H2,1-3H3