3-[2,6-bis(azanyl)purin-9-yl]oxy-2-(diethoxyphosphorylmethoxy)propan-1-ol

Systemtic Name: 3-[2,6-bis(azanyl)purin-9-yl]oxy-2-(diethoxyphosphorylmethoxy)propan-1-ol Openeye Name: 3-(2,6-diaminopurin-9-yl)oxy-2-(diethoxyphosphorylmethoxy)propan-1-ol CAS Name: 3-[(2,6-diamino-9-purinyl)oxy]-2-(diethoxyphosphorylmethoxy)-1-propanol IUPAC Name: 3-(2,6-diaminopurin-9-yl)oxy-2-(diethoxyphosphorylmethoxy)propan-1-ol Traditional Name: 3-(2,6-diaminopurin-9-yl)oxy-2-(diethoxyphosphorylmethoxy)propan-1-ol Formula: C13H23N6O6P MolecularWeight: 390.332081

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COC(CO)CON1C=NC2=C1N=C(N=C2N)N)OCC

Isomeric SMILES

CCOP(=O)(COC(CO)CON1C=NC2=C1N=C(N=C2N)N)OCC

InChI

InChI=1S/C13H23N6O6P/c1-3-24-26(21,25-4-2)8-22-9(5-20)6-23-19-7-16-10-11(14)17-13(15)18-12(10)19/h7,9,20H,3-6,8H2,1-2H3,(H4,14,15,17,18)