ethyl 2-cyano-2-(2,6-dimethylphenyl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(2,6-dimethylphenyl)ethanoate Openeye Name: ethyl 2-cyano-2-(2,6-dimethylphenyl)acetate CAS Name: 2-cyano-2-(2,6-dimethylphenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(2,6-dimethylphenyl)acetate Traditional Name: 2-cyano-2-(2,6-dimethylphenyl)acetic acid ethyl ester Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=C(C=CC=C1C)C

Isomeric SMILES

CCOC(=O)C(C#N)C1=C(C=CC=C1C)C

InChI

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