butan-2-yl 4-cyano-2-oxidanyl-butanoate

Systemtic Name: butan-2-yl 4-cyano-2-oxidanyl-butanoate Openeye Name: sec-butyl 4-cyano-2-hydroxy-butanoate CAS Name: 4-cyano-2-hydroxybutanoic acid butan-2-yl ester IUPAC Name: butan-2-yl 4-cyano-2-hydroxybutanoate Traditional Name: 4-cyano-2-hydroxy-butyric acid sec-butyl ester Formula: C9H15NO3 MolecularWeight: 185.2203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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