ethyl 4-[(4-chlorophenyl)-(cyanomethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(4-chlorophenyl)-(cyanomethyl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-chloro-N-(cyanomethyl)anilino]-4-oxo-butanoate CAS Name: 4-[4-chloro-N-(cyanomethyl)anilino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-chloro-N-(cyanomethyl)anilino]-4-oxobutanoate Traditional Name: 4-[4-chloro-N-(cyanomethyl)anilino]-4-keto-butyric acid ethyl ester Formula: C14H15ClN2O3 MolecularWeight: 294.7335

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClN2O3/c1-2-20-14(19)8-7-13(18)17(10-9-16)12-5-3-11(15)4-6-12/h3-6H,2,7-8,10H2,1H3