2-[6-(2-hydroxyethylamino)purin-9-yl]ethoxymethylphosphonic acid

Systemtic Name: 2-[6-(2-hydroxyethylamino)purin-9-yl]ethoxymethylphosphonic acid Openeye Name: 2-[6-(2-hydroxyethylamino)purin-9-yl]ethoxymethylphosphonic acid CAS Name: 2-[6-(2-hydroxyethylamino)-9-purinyl]ethoxymethylphosphonic acid IUPAC Name: 2-[6-(2-hydroxyethylamino)purin-9-yl]ethoxymethylphosphonic acid Traditional Name: 2-[6-(2-hydroxyethylamino)purin-9-yl]ethoxymethylphosphonic acid Formula: C10H16N5O5P MolecularWeight: 317.238301

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)NCCO)N=CN2CCOCP(=O)(O)O

Isomeric SMILES

C1=NC2=C(C(=N1)NCCO)N=CN2CCOCP(=O)(O)O

InChI

InChI=1S/C10H16N5O5P/c16-3-1-11-9-8-10(13-5-12-9)15(6-14-8)2-4-20-7-21(17,18)19/h5-6,16H,1-4,7H2,(H,11,12,13)(H2,17,18,19)