ethyl 2-cyano-2-[4-(cyanomethyl)phenyl]ethanoate

Systemtic Name: ethyl 2-cyano-2-[4-(cyanomethyl)phenyl]ethanoate Openeye Name: ethyl 2-cyano-2-[4-(cyanomethyl)phenyl]acetate CAS Name: 2-cyano-2-[4-(cyanomethyl)phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-[4-(cyanomethyl)phenyl]acetate Traditional Name: 2-cyano-2-[4-(cyanomethyl)phenyl]acetic acid ethyl ester Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O2/c1-2-17-13(16)12(9-15)11-5-3-10(4-6-11)7-8-14/h3-6,12H,2,7H2,1H3