2-(4-ethoxyphenyl)carbonylbutanenitrile

Systemtic Name: 2-(4-ethoxyphenyl)carbonylbutanenitrile Openeye Name: 2-(4-ethoxybenzoyl)butanenitrile CAS Name: 2-[(4-ethoxyphenyl)-oxomethyl]butanenitrile IUPAC Name: 2-(4-ethoxybenzoyl)butanenitrile Traditional Name: 2-(4-ethoxybenzoyl)butyronitrile Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO2/c1-3-10(9-14)13(15)11-5-7-12(8-6-11)16-4-2/h5-8,10H,3-4H2,1-2H3