1,3-dimethyl-7-oxidanyl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-oxidanyl-purine-2,6-dione Openeye Name: 7-hydroxy-1,3-dimethyl-purine-2,6-dione CAS Name: 7-hydroxy-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-hydroxy-1,3-dimethylpurine-2,6-dione Traditional Name: 7-hydroxy-1,3-dimethyl-xanthine Formula: C7H8N4O3 MolecularWeight: 196.16342

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)O

InChI

InChI=1S/C7H8N4O3/c1-9-5-4(11(14)3-8-5)6(12)10(2)7(9)13/h3,14H,1-2H3