methyl 5-cyano-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-cyano-3-methyl-5-oxidanylidene-pentanoate Openeye Name: methyl 5-cyano-3-methyl-5-oxo-pentanoate CAS Name: 5-cyano-3-methyl-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-cyano-3-methyl-5-oxopentanoate Traditional Name: 5-cyano-5-keto-3-methyl-valeric acid methyl ester Formula: C8H11NO3 MolecularWeight: 169.17784

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C#N)CC(=O)OC

Isomeric SMILES

CC(CC(=O)C#N)CC(=O)OC

InChI

InChI=1S/C8H11NO3/c1-6(3-7(10)5-9)4-8(11)12-2/h6H,3-4H2,1-2H3