9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-8-methyl-3H-purine-2,6-dione

Systemtic Name: 9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-8-methyl-3H-purine-2,6-dione Openeye Name: 9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-8-methyl-3H-purine-2,6-dione CAS Name: 9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-8-methyl-3H-purine-2,6-dione IUPAC Name: 9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-8-methyl-3H-purine-2,6-dione Traditional Name: 9-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-8-methyl-xanthine Formula: C11H14N4O5 MolecularWeight: 282.25266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3CC(C(O3)CO)O)NC(=O)NC2=O

Isomeric SMILES

CC1=NC2=C(N1C3CC(C(O3)CO)O)NC(=O)NC2=O

InChI

InChI=1S/C11H14N4O5/c1-4-12-8-9(13-11(19)14-10(8)18)15(4)7-2-5(17)6(3-16)20-7/h5-7,16-17H,2-3H2,1H3,(H2,13,14,18,19)