ethyl 3-(2-cyanopropanoyl)benzoate

Systemtic Name: ethyl 3-(2-cyanopropanoyl)benzoate Openeye Name: ethyl 3-(2-cyanopropanoyl)benzoate CAS Name: 3-(2-cyano-1-oxopropyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-(2-cyanopropanoyl)benzoate Traditional Name: 3-(2-cyanopropanoyl)benzoic acid ethyl ester Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO3/c1-3-17-13(16)11-6-4-5-10(7-11)12(15)9(2)8-14/h4-7,9H,3H2,1-2H3