methyl 4-bromanyl-2-cyano-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-bromanyl-2-cyano-3-oxidanylidene-butanoate Openeye Name: methyl 4-bromo-2-cyano-3-oxo-butanoate CAS Name: 4-bromo-2-cyano-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-bromo-2-cyano-3-oxobutanoate Traditional Name: 4-bromo-2-cyano-3-keto-butyric acid methyl ester Formula: C6H6BrNO3 MolecularWeight: 220.02074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C(=O)CBr

Isomeric SMILES

COC(=O)C(C#N)C(=O)CBr

InChI

InChI=1S/C6H6BrNO3/c1-11-6(10)4(3-8)5(9)2-7/h4H,2H2,1H3