[1-phosphono-2-(pyrimidin-2-ylamino)ethyl]phosphonic acid

Systemtic Name: [1-phosphono-2-(pyrimidin-2-ylamino)ethyl]phosphonic acid Openeye Name: [1-phosphono-2-(pyrimidin-2-ylamino)ethyl]phosphonic acid CAS Name: [1-phosphono-2-(2-pyrimidinylamino)ethyl]phosphonic acid IUPAC Name: [1-phosphono-2-(pyrimidin-2-ylamino)ethyl]phosphonic acid Traditional Name: [1-phosphono-2-(2-pyrimidylamino)ethyl]phosphonic acid Formula: C6H11N3O6P2 MolecularWeight: 283.115562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CN=C(N=C1)NCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C6H11N3O6P2/c10-16(11,12)5(17(13,14)15)4-9-6-7-2-1-3-8-6/h1-3,5H,4H2,(H,7,8,9)(H2,10,11,12)(H2,13,14,15)