methyl 2-cyano-4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: methyl 2-cyano-4-oxidanylidene-4-phenyl-butanoate Openeye Name: methyl 2-cyano-4-oxo-4-phenyl-butanoate CAS Name: 2-cyano-4-oxo-4-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-cyano-4-oxo-4-phenylbutanoate Traditional Name: 2-cyano-4-keto-4-phenyl-butyric acid methyl ester Formula: C12H11NO3 MolecularWeight: 217.22064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO3/c1-16-12(15)10(8-13)7-11(14)9-5-3-2-4-6-9/h2-6,10H,7H2,1H3