ethyl 4-[(4-chlorophenyl)amino]-2-cyano-butanoate

Systemtic Name: ethyl 4-[(4-chlorophenyl)amino]-2-cyano-butanoate Openeye Name: ethyl 4-(4-chloroanilino)-2-cyano-butanoate CAS Name: 4-(4-chloroanilino)-2-cyanobutanoic acid ethyl ester IUPAC Name: ethyl 4-(4-chloroanilino)-2-cyanobutanoate Traditional Name: 4-(4-chloroanilino)-2-cyano-butyric acid ethyl ester Formula: C13H15ClN2O2 MolecularWeight: 266.7234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCNC1=CC=C(C=C1)Cl)C#N

Isomeric SMILES

CCOC(=O)C(CCNC1=CC=C(C=C1)Cl)C#N

InChI

InChI=1S/C13H15ClN2O2/c1-2-18-13(17)10(9-15)7-8-16-12-5-3-11(14)4-6-12/h3-6,10,16H,2,7-8H2,1H3