[1-oxidanyl-1-phosphono-2-(2H-1,2,3-triazol-4-yl)ethyl]phosphonic acid

Systemtic Name: [1-oxidanyl-1-phosphono-2-(2H-1,2,3-triazol-4-yl)ethyl]phosphonic acid Openeye Name: [1-hydroxy-1-phosphono-2-(2H-triazol-4-yl)ethyl]phosphonic acid CAS Name: [1-hydroxy-1-phosphono-2-(2H-triazol-4-yl)ethyl]phosphonic acid IUPAC Name: [1-hydroxy-1-phosphono-2-(2H-triazol-4-yl)ethyl]phosphonic acid Traditional Name: [1-hydroxy-1-phosphono-2-(2H-triazol-4-yl)ethyl]phosphonic acid Formula: C4H9N3O7P2 MolecularWeight: 273.077682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NNN=C1CC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=NNN=C1CC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C4H9N3O7P2/c8-4(15(9,10)11,16(12,13)14)1-3-2-5-7-6-3/h2,8H,1H2,(H,5,6,7)(H2,9,10,11)(H2,12,13,14)