propan-2-yl 4-cyano-3-oxidanyl-butanoate

Systemtic Name: propan-2-yl 4-cyano-3-oxidanyl-butanoate Openeye Name: isopropyl 4-cyano-3-hydroxy-butanoate CAS Name: 4-cyano-3-hydroxybutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-hydroxybutanoate Traditional Name: 4-cyano-3-hydroxy-butyric acid isopropyl ester Formula: C8H13NO3 MolecularWeight: 171.19372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H13NO3/c1-6(2)12-8(11)5-7(10)3-4-9/h6-7,10H,3,5H2,1-2H3