1-(9,9a-dihydroimidazo[2,1-f]purin-3-yl)propan-2-yloxymethylphosphonic acid

Systemtic Name: 1-(9,9a-dihydroimidazo[2,1-f]purin-3-yl)propan-2-yloxymethylphosphonic acid Openeye Name: [2-(9,9a-dihydroimidazo[2,1-f]purin-3-yl)-1-methyl-ethoxy]methylphosphonic acid CAS Name: 1-(9,9a-dihydroimidazo[2,1-f]purin-3-yl)propan-2-yloxymethylphosphonic acid IUPAC Name: 1-(9,9a-dihydroimidazo[2,1-f]purin-3-yl)propan-2-yloxymethylphosphonic acid Traditional Name: [2-(9,9a-dihydroimidazo[2,1-f]purin-3-yl)-1-methyl-ethoxy]methylphosphonic acid Formula: C11H16N5O4P MolecularWeight: 313.249601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1N=CN3C2NC=C3)OCP(=O)(O)O

Isomeric SMILES

CC(CN1C=NC2=C1N=CN3C2NC=C3)OCP(=O)(O)O

InChI

InChI=1S/C11H16N5O4P/c1-8(20-7-21(17,18)19)4-16-5-13-9-10-12-2-3-15(10)6-14-11(9)16/h2-3,5-6,8,10,12H,4,7H2,1H3,(H2,17,18,19)