ethyl 4-cyano-3,5-dimethyl-benzoate

Systemtic Name: ethyl 4-cyano-3,5-dimethyl-benzoate Openeye Name: ethyl 4-cyano-3,5-dimethyl-benzoate CAS Name: 4-cyano-3,5-dimethylbenzoic acid ethyl ester IUPAC Name: ethyl 4-cyano-3,5-dimethylbenzoate Traditional Name: 4-cyano-3,5-dimethyl-benzoic acid ethyl ester Formula: C12H13NO2 MolecularWeight: 203.23712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO2/c1-4-15-12(14)10-5-8(2)11(7-13)9(3)6-10/h5-6H,4H2,1-3H3