[(2S)-1-[6-(cyclopropylamino)purin-9-yl]propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-[6-(cyclopropylamino)purin-9-yl]propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-2-[6-(cyclopropylamino)purin-9-yl]-1-methyl-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-[6-(cyclopropylamino)-9-purinyl]propan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-[6-(cyclopropylamino)purin-9-yl]propan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-2-[6-(cyclopropylamino)purin-9-yl]-1-methyl-ethoxy]methylphosphonic acid Formula: C12H18N5O4P MolecularWeight: 327.276181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1N=CN=C2NC3CC3)OCP(=O)(O)O

Isomeric SMILES

C[C@@H](CN1C=NC2=C1N=CN=C2NC3CC3)OCP(=O)(O)O

InChI

InChI=1S/C12H18N5O4P/c1-8(21-7-22(18,19)20)4-17-6-15-10-11(16-9-2-3-9)13-5-14-12(10)17/h5-6,8-9H,2-4,7H2,1H3,(H,13,14,16)(H2,18,19,20)/t8-/m0/s1