5-[2-chloranyl-6-(1-hydroxyethylamino)purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: 5-[2-chloranyl-6-(1-hydroxyethylamino)purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 5-[2-chloro-6-(1-hydroxyethylamino)purin-9-yl]-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 5-[2-chloro-6-(1-hydroxyethylamino)-9-purinyl]-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 5-[2-chloro-6-(1-hydroxyethylamino)purin-9-yl]-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-[2-chloro-6-(1-hydroxyethylamino)purin-9-yl]-2-methylol-tetrahydrofuran-3-ol Formula: C12H16ClN5O4 MolecularWeight: 329.73954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(NC1=NC(=NC2=C1N=CN2C3CC(C(O3)CO)O)Cl)O

Isomeric SMILES

CC(NC1=NC(=NC2=C1N=CN2C3CC(C(O3)CO)O)Cl)O

InChI

InChI=1S/C12H16ClN5O4/c1-5(20)15-10-9-11(17-12(13)16-10)18(4-14-9)8-2-6(21)7(3-19)22-8/h4-8,19-21H,2-3H2,1H3,(H,15,16,17)