[3-(5-azanyl-2H-1,2,3-triazol-4-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-(5-azanyl-2H-1,2,3-triazol-4-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [3-(5-amino-2H-triazol-4-yl)-1-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [3-(5-amino-2H-triazol-4-yl)-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [3-(5-amino-2H-triazol-4-yl)-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [3-(5-amino-2H-triazol-4-yl)-1-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C5H12N4O7P2 MolecularWeight: 302.118902

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(O)(P(=O)(O)O)P(=O)(O)O)C1=NNN=C1N

Isomeric SMILES

C(CC(O)(P(=O)(O)O)P(=O)(O)O)C1=NNN=C1N

InChI

InChI=1S/C5H12N4O7P2/c6-4-3(7-9-8-4)1-2-5(10,17(11,12)13)18(14,15)16/h10H,1-2H2,(H2,11,12,13)(H2,14,15,16)(H3,6,7,8,9)