2,2,4,4-tetramethylpentan-3-yl (2R)-2-cyano-2-methyl-5-oxidanylidene-pentanoate

Systemtic Name: 2,2,4,4-tetramethylpentan-3-yl (2R)-2-cyano-2-methyl-5-oxidanylidene-pentanoate Openeye Name: (1-tert-butyl-2,2-dimethyl-propyl) (2R)-2-cyano-2-methyl-5-oxo-pentanoate CAS Name: (2R)-2-cyano-2-methyl-5-oxopentanoic acid 2,2,4,4-tetramethylpentan-3-yl ester IUPAC Name: 2,2,4,4-tetramethylpentan-3-yl (2R)-2-cyano-2-methyl-5-oxopentanoate Traditional Name: (2R)-2-cyano-5-keto-2-methyl-valeric acid (1-tert-butyl-2,2-dimethyl-propyl) ester Formula: C16H27NO3 MolecularWeight: 281.39048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@](CCC=O)(C#N)C(=O)OC(C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C16H27NO3/c1-14(2,3)12(15(4,5)6)20-13(19)16(7,11-17)9-8-10-18/h10,12H,8-9H2,1-7H3/t16-/m1/s1