9-[3-(dimethylamino)-2-[di(propan-2-yloxy)phosphorylmethoxy]propyl]purin-6-amine

Systemtic Name: 9-[3-(dimethylamino)-2-[di(propan-2-yloxy)phosphorylmethoxy]propyl]purin-6-amine Openeye Name: 9-[2-(diisopropoxyphosphorylmethoxy)-3-(dimethylamino)propyl]purin-6-amine CAS Name: 9-[3-(dimethylamino)-2-[di(propan-2-yloxy)phosphorylmethoxy]propyl]-6-purinamine IUPAC Name: 9-[3-(dimethylamino)-2-[di(propan-2-yloxy)phosphorylmethoxy]propyl]purin-6-amine Traditional Name: [3-adenin-9-yl-2-(diisopropoxyphosphorylmethoxy)propyl]-dimethyl-amine Formula: C17H31N6O4P MolecularWeight: 414.439601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(COC(CN1C=NC2=C1N=CN=C2N)CN(C)C)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(COC(CN1C=NC2=C1N=CN=C2N)CN(C)C)OC(C)C

InChI

InChI=1S/C17H31N6O4P/c1-12(2)26-28(24,27-13(3)4)11-25-14(7-22(5)6)8-23-10-21-15-16(18)19-9-20-17(15)23/h9-10,12-14H,7-8,11H2,1-6H3,(H2,18,19,20)