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

Systemtic Name: [2-(2-methyl-1,2,4-triazol-3-yl)-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-(2-methyl-1,2,4-triazol-3-yl)-1-phosphono-ethyl]phosphonic acid CAS Name: [2-(2-methyl-1,2,4-triazol-3-yl)-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-(2-methyl-1,2,4-triazol-3-yl)-1-phosphonoethyl]phosphonic acid Traditional Name: [2-(2-methyl-1,2,4-triazol-3-yl)-1-phosphono-ethyl]phosphonic acid Formula: C5H11N3O6P2 MolecularWeight: 271.104862

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC=N1)CC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN1C(=NC=N1)CC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H11N3O6P2/c1-8-4(6-3-7-8)2-5(15(9,10)11)16(12,13)14/h3,5H,2H2,1H3,(H2,9,10,11)(H2,12,13,14)