ethyl 4-cyano-2-(phenylcarbonyl)butanoate

Systemtic Name: ethyl 4-cyano-2-(phenylcarbonyl)butanoate Openeye Name: ethyl 2-benzoyl-4-cyano-butanoate CAS Name: 2-benzoyl-4-cyanobutanoic acid ethyl ester IUPAC Name: ethyl 2-benzoyl-4-cyanobutanoate Traditional Name: 2-benzoyl-4-cyano-butyric acid ethyl ester Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO3/c1-2-18-14(17)12(9-6-10-15)13(16)11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9H2,1H3