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

Systemtic Name: [3-[2-azanyl-6-(dimethylamino)purin-9-yl]-2-oxidanyl-propoxy]methylphosphonic acid Openeye Name: [3-[2-amino-6-(dimethylamino)purin-9-yl]-2-hydroxy-propoxy]methylphosphonic acid CAS Name: [3-[2-amino-6-(dimethylamino)-9-purinyl]-2-hydroxypropoxy]methylphosphonic acid IUPAC Name: [3-[2-amino-6-(dimethylamino)purin-9-yl]-2-hydroxypropoxy]methylphosphonic acid Traditional Name: [3-[2-amino-6-(dimethylamino)purin-9-yl]-2-hydroxy-propoxy]methylphosphonic acid Formula: C11H19N6O5P MolecularWeight: 346.279521

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=C1N=CN2CC(COCP(=O)(O)O)O)N

Isomeric SMILES

CN(C)C1=NC(=NC2=C1N=CN2CC(COCP(=O)(O)O)O)N

InChI

InChI=1S/C11H19N6O5P/c1-16(2)9-8-10(15-11(12)14-9)17(5-13-8)3-7(18)4-22-6-23(19,20)21/h5,7,18H,3-4,6H2,1-2H3,(H2,12,14,15)(H2,19,20,21)