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

Systemtic Name: 1-methyl-3-oxidanyl-7H-purine-2,6-dione Openeye Name: 3-hydroxy-1-methyl-7H-purine-2,6-dione CAS Name: 3-hydroxy-1-methyl-7H-purine-2,6-dione IUPAC Name: 3-hydroxy-1-methyl-7H-purine-2,6-dione Traditional Name: 3-hydroxy-1-methyl-7H-purine-2,6-quinone Formula: C6H6N4O3 MolecularWeight: 182.13684

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=CN2)N(C1=O)O

Isomeric SMILES

CN1C(=O)C2=C(N=CN2)N(C1=O)O

InChI

InChI=1S/C6H6N4O3/c1-9-5(11)3-4(8-2-7-3)10(13)6(9)12/h2,13H,1H3,(H,7,8)