1-[2,6-bis(azanyl)purin-3-yl]ethoxymethylphosphonic acid

Systemtic Name: 1-[2,6-bis(azanyl)purin-3-yl]ethoxymethylphosphonic acid Openeye Name: 1-(2,6-diaminopurin-3-yl)ethoxymethylphosphonic acid CAS Name: 1-(2,6-diamino-3-purinyl)ethoxymethylphosphonic acid IUPAC Name: 1-(2,6-diaminopurin-3-yl)ethoxymethylphosphonic acid Traditional Name: 1-(2,6-diaminopurin-3-yl)ethoxymethylphosphonic acid Formula: C8H13N6O4P MolecularWeight: 288.200381

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1C2=NC=NC2=C(N=C1N)N)OCP(=O)(O)O

Isomeric SMILES

CC(N1C2=NC=NC2=C(N=C1N)N)OCP(=O)(O)O

InChI

InChI=1S/C8H13N6O4P/c1-4(18-3-19(15,16)17)14-7-5(11-2-12-7)6(9)13-8(14)10/h2,4H,3,9H2,1H3,(H2,10,13)(H2,15,16,17)