[phosphono-(1H-1,2,4-triazol-5-ylamino)methyl]phosphonic acid

Systemtic Name: [phosphono-(1H-1,2,4-triazol-5-ylamino)methyl]phosphonic acid Openeye Name: [phosphono-(1H-1,2,4-triazol-5-ylamino)methyl]phosphonic acid CAS Name: [phosphono-(1H-1,2,4-triazol-5-ylamino)methyl]phosphonic acid IUPAC Name: [phosphono-(1H-1,2,4-triazol-5-ylamino)methyl]phosphonic acid Traditional Name: [phosphono-(1H-1,2,4-triazol-5-ylamino)methyl]phosphonic acid Formula: C3H8N4O6P2 MolecularWeight: 258.066342

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Descriptors Computed from Structure

Canonical SMILES:

C1=NNC(=N1)NC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=NNC(=N1)NC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C3H8N4O6P2/c8-14(9,10)3(15(11,12)13)6-2-4-1-5-7-2/h1,3H,(H2,8,9,10)(H2,11,12,13)(H2,4,5,6,7)