ethyl 2-cyano-2-(4-ethylphenyl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(4-ethylphenyl)ethanoate Openeye Name: ethyl 2-cyano-2-(4-ethylphenyl)acetate CAS Name: 2-cyano-2-(4-ethylphenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(4-ethylphenyl)acetate Traditional Name: 2-cyano-2-(4-ethylphenyl)acetic acid ethyl ester Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C#N)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)C(C#N)C(=O)OCC

InChI

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