4-cyano-2-oxidanyl-2-phosphono-butanoic acid

Systemtic Name: 4-cyano-2-oxidanyl-2-phosphono-butanoic acid Openeye Name: 4-cyano-2-hydroxy-2-phosphono-butanoic acid CAS Name: 4-cyano-2-hydroxy-2-phosphonobutanoic acid IUPAC Name: 4-cyano-2-hydroxy-2-phosphonobutanoic acid Traditional Name: 4-cyano-2-hydroxy-2-phosphono-butyric acid Formula: C5H8NO6P MolecularWeight: 209.093881

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H8NO6P/c6-3-1-2-5(9,4(7)8)13(10,11)12/h9H,1-2H2,(H,7,8)(H2,10,11,12)