methyl 2-(4-tert-butylphenyl)-2-cyano-ethanoate

Systemtic Name: methyl 2-(4-tert-butylphenyl)-2-cyano-ethanoate Openeye Name: methyl 2-(4-tert-butylphenyl)-2-cyano-acetate CAS Name: 2-(4-tert-butylphenyl)-2-cyanoacetic acid methyl ester IUPAC Name: methyl 2-(4-tert-butylphenyl)-2-cyanoacetate Traditional Name: 2-(4-tert-butylphenyl)-2-cyano-acetic acid methyl ester Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO2/c1-14(2,3)11-7-5-10(6-8-11)12(9-15)13(16)17-4/h5-8,12H,1-4H3