2,2,4,4-tetramethylpentan-3-yl 2-cyanopropanoate

Systemtic Name: 2,2,4,4-tetramethylpentan-3-yl 2-cyanopropanoate Openeye Name: (1-tert-butyl-2,2-dimethyl-propyl) 2-cyanopropanoate CAS Name: 2-cyanopropanoic acid 2,2,4,4-tetramethylpentan-3-yl ester IUPAC Name: 2,2,4,4-tetramethylpentan-3-yl 2-cyanopropanoate Traditional Name: 2-cyanopropionic acid (1-tert-butyl-2,2-dimethyl-propyl) ester Formula: C13H23NO2 MolecularWeight: 225.32722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23NO2/c1-9(8-14)10(15)16-11(12(2,3)4)13(5,6)7/h9,11H,1-7H3