methyl 4-(4-chlorophenyl)-2-cyano-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(4-chlorophenyl)-2-cyano-4-oxidanylidene-butanoate Openeye Name: methyl 4-(4-chlorophenyl)-2-cyano-4-oxo-butanoate CAS Name: 4-(4-chlorophenyl)-2-cyano-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(4-chlorophenyl)-2-cyano-4-oxobutanoate Traditional Name: 4-(4-chlorophenyl)-2-cyano-4-keto-butyric acid methyl ester Formula: C12H10ClNO3 MolecularWeight: 251.6657

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)C1=CC=C(C=C1)Cl)C#N

Isomeric SMILES

COC(=O)C(CC(=O)C1=CC=C(C=C1)Cl)C#N

InChI

InChI=1S/C12H10ClNO3/c1-17-12(16)9(7-14)6-11(15)8-2-4-10(13)5-3-8/h2-5,9H,6H2,1H3