[3-[6-(2-methoxyethylamino)purin-9-yl]-2-oxidanyl-propoxy]methylphosphonic acid

Systemtic Name: [3-[6-(2-methoxyethylamino)purin-9-yl]-2-oxidanyl-propoxy]methylphosphonic acid Openeye Name: [2-hydroxy-3-[6-(2-methoxyethylamino)purin-9-yl]propoxy]methylphosphonic acid CAS Name: [2-hydroxy-3-[6-(2-methoxyethylamino)-9-purinyl]propoxy]methylphosphonic acid IUPAC Name: [2-hydroxy-3-[6-(2-methoxyethylamino)purin-9-yl]propoxy]methylphosphonic acid Traditional Name: [2-hydroxy-3-[6-(2-methoxyethylamino)purin-9-yl]propoxy]methylphosphonic acid Formula: C12H20N5O6P MolecularWeight: 361.290861

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC=NC2=C1N=CN2CC(COCP(=O)(O)O)O

Isomeric SMILES

COCCNC1=NC=NC2=C1N=CN2CC(COCP(=O)(O)O)O

InChI

InChI=1S/C12H20N5O6P/c1-22-3-2-13-11-10-12(15-6-14-11)17(7-16-10)4-9(18)5-23-8-24(19,20)21/h6-7,9,18H,2-5,8H2,1H3,(H,13,14,15)(H2,19,20,21)