(2-cyano-1-oxidanyl-1-phosphono-ethyl)phosphonic acid

Systemtic Name: (2-cyano-1-oxidanyl-1-phosphono-ethyl)phosphonic acid Openeye Name: (2-cyano-1-hydroxy-1-phosphono-ethyl)phosphonic acid CAS Name: (2-cyano-1-hydroxy-1-phosphonoethyl)phosphonic acid IUPAC Name: (2-cyano-1-hydroxy-1-phosphonoethyl)phosphonic acid Traditional Name: (2-cyano-1-hydroxy-1-phosphono-ethyl)phosphonic acid Formula: C3H7NO7P2 MolecularWeight: 231.037702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C3H7NO7P2/c4-2-1-3(5,12(6,7)8)13(9,10)11/h5H,1H2,(H2,6,7,8)(H2,9,10,11)