9-(3-methyl-1-oxidanyl-butan-2-yl)-3H-purin-6-one

Systemtic Name: 9-(3-methyl-1-oxidanyl-butan-2-yl)-3H-purin-6-one Openeye Name: 9-[1-(hydroxymethyl)-2-methyl-propyl]-3H-purin-6-one CAS Name: 9-(1-hydroxy-3-methylbutan-2-yl)-3H-purin-6-one IUPAC Name: 9-(1-hydroxy-3-methylbutan-2-yl)-3H-purin-6-one Traditional Name: 9-(2-methyl-1-methylol-propyl)-3H-purin-6-one Formula: C10H14N4O2 MolecularWeight: 222.24376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)N1C=NC2=C1NC=NC2=O

Isomeric SMILES

CC(C)C(CO)N1C=NC2=C1NC=NC2=O

InChI

InChI=1S/C10H14N4O2/c1-6(2)7(3-15)14-5-13-8-9(14)11-4-12-10(8)16/h4-7,15H,3H2,1-2H3,(H,11,12,16)