[2-(6-aminopurin-9-yl)-1,1,2,2-tetradeuterio-ethoxy]methylphosphonic acid

Systemtic Name: [2-(6-aminopurin-9-yl)-1,1,2,2-tetradeuterio-ethoxy]methylphosphonic acid Openeye Name: [2-(6-aminopurin-9-yl)-1,1,2,2-tetradeuterio-ethoxy]methylphosphonic acid CAS Name: [2-(6-aminopurin-9-yl)-1,1,2,2-tetradeuterioethoxy]methylphosphonic acid IUPAC Name: [2-(6-aminopurin-9-yl)-1,1,2,2-tetradeuterioethoxy]methylphosphonic acid Traditional Name: (2-adenin-9-yl-1,1,2,2-tetradeuterio-ethoxy)methylphosphonic acid Formula: C8H12N5O4P MolecularWeight: 277.210388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C([2H])(C([2H])([2H])OCP(=O)(O)O)N1C=NC2=C1N=CN=C2N

InChI

InChI=1S/C8H12N5O4P/c9-7-6-8(11-3-10-7)13(4-12-6)1-2-17-5-18(14,15)16/h3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16)/i1D2,2D2