tert-butyl 4-cyano-3-oxidanyl-butanoate

Systemtic Name: tert-butyl 4-cyano-3-oxidanyl-butanoate Openeye Name: tert-butyl 4-cyano-3-hydroxy-butanoate CAS Name: 4-cyano-3-hydroxybutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-cyano-3-hydroxybutanoate Traditional Name: 4-cyano-3-hydroxy-butyric acid tert-butyl ester Formula: C9H15NO3 MolecularWeight: 185.2203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15NO3/c1-9(2,3)13-8(12)6-7(11)4-5-10/h7,11H,4,6H2,1-3H3