ethyl 2-cyano-2-(3-methylphenyl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(3-methylphenyl)ethanoate Openeye Name: ethyl 2-cyano-2-(m-tolyl)acetate CAS Name: 2-cyano-2-(3-methylphenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(3-methylphenyl)acetate Traditional Name: 2-cyano-2-(m-tolyl)acetic acid ethyl ester Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO2/c1-3-15-12(14)11(8-13)10-6-4-5-9(2)7-10/h4-7,11H,3H2,1-2H3