2-[7-methyl-1-oxidanyl-2,6-bis(oxidanylidene)purin-3-yl]ethylphosphonic acid

Systemtic Name: 2-[7-methyl-1-oxidanyl-2,6-bis(oxidanylidene)purin-3-yl]ethylphosphonic acid Openeye Name: 2-(1-hydroxy-7-methyl-2,6-dioxo-purin-3-yl)ethylphosphonic acid CAS Name: 2-(1-hydroxy-7-methyl-2,6-dioxo-3-purinyl)ethylphosphonic acid IUPAC Name: 2-(1-hydroxy-7-methyl-2,6-dioxopurin-3-yl)ethylphosphonic acid Traditional Name: 2-(1-hydroxy-2,6-diketo-7-methyl-purin-3-yl)ethylphosphonic acid Formula: C8H11N4O6P MolecularWeight: 290.169901

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2CCP(=O)(O)O)O

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2CCP(=O)(O)O)O

InChI

InChI=1S/C8H11N4O6P/c1-10-4-9-6-5(10)7(13)12(15)8(14)11(6)2-3-19(16,17)18/h4,15H,2-3H2,1H3,(H2,16,17,18)