ethyl 4-(4-chlorophenyl)-2-cyano-butanoate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-cyano-butanoate Openeye Name: ethyl 4-(4-chlorophenyl)-2-cyano-butanoate CAS Name: 4-(4-chlorophenyl)-2-cyanobutanoic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-cyanobutanoate Traditional Name: 4-(4-chlorophenyl)-2-cyano-butyric acid ethyl ester Formula: C13H14ClNO2 MolecularWeight: 251.70876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=C(C=C1)Cl)C#N

Isomeric SMILES

CCOC(=O)C(CCC1=CC=C(C=C1)Cl)C#N

InChI

InChI=1S/C13H14ClNO2/c1-2-17-13(16)11(9-15)6-3-10-4-7-12(14)8-5-10/h4-5,7-8,11H,2-3,6H2,1H3