tert-butyl 4-cyano-2,4-dimethyl-3-oxidanylidene-pentanoate

Systemtic Name: tert-butyl 4-cyano-2,4-dimethyl-3-oxidanylidene-pentanoate Openeye Name: tert-butyl 4-cyano-2,4-dimethyl-3-oxo-pentanoate CAS Name: 4-cyano-2,4-dimethyl-3-oxopentanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-cyano-2,4-dimethyl-3-oxopentanoate Traditional Name: 4-cyano-3-keto-2,4-dimethyl-valeric acid tert-butyl ester Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO3/c1-8(9(14)12(5,6)7-13)10(15)16-11(2,3)4/h8H,1-6H3