1-methyl-7-(2-methyl-2-oxidanyl-propyl)-3H-purine-2,6-dione

Systemtic Name: 1-methyl-7-(2-methyl-2-oxidanyl-propyl)-3H-purine-2,6-dione Openeye Name: 7-(2-hydroxy-2-methyl-propyl)-1-methyl-3H-purine-2,6-dione CAS Name: 7-(2-hydroxy-2-methylpropyl)-1-methyl-3H-purine-2,6-dione IUPAC Name: 7-(2-hydroxy-2-methylpropyl)-1-methyl-3H-purine-2,6-dione Traditional Name: 7-(2-hydroxy-2-methyl-propyl)-1-methyl-xanthine Formula: C10H14N4O3 MolecularWeight: 238.24316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1C=NC2=C1C(=O)N(C(=O)N2)C)O

Isomeric SMILES

CC(C)(CN1C=NC2=C1C(=O)N(C(=O)N2)C)O

InChI

InChI=1S/C10H14N4O3/c1-10(2,17)4-14-5-11-7-6(14)8(15)13(3)9(16)12-7/h5,17H,4H2,1-3H3,(H,12,16)