methyl (5R)-6-cyano-5-oxidanyl-3-oxidanylidene-hexanoate

Systemtic Name: methyl (5R)-6-cyano-5-oxidanyl-3-oxidanylidene-hexanoate Openeye Name: methyl (5R)-6-cyano-5-hydroxy-3-oxo-hexanoate CAS Name: (5R)-6-cyano-5-hydroxy-3-oxohexanoic acid methyl ester IUPAC Name: methyl (5R)-6-cyano-5-hydroxy-3-oxohexanoate Traditional Name: (5R)-6-cyano-5-hydroxy-3-keto-hexanoic acid methyl ester Formula: C8H11NO4 MolecularWeight: 185.17724

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)CC(CC#N)O

Isomeric SMILES

COC(=O)CC(=O)C[C@@H](CC#N)O

InChI

InChI=1S/C8H11NO4/c1-13-8(12)5-7(11)4-6(10)2-3-9/h6,10H,2,4-5H2,1H3/t6-/m1/s1