7,9-dimethyl-6-oxidanylidene-3H-purin-9-ium-2-olate

Systemtic Name: 7,9-dimethyl-6-oxidanylidene-3H-purin-9-ium-2-olate Openeye Name: 7,9-dimethyl-6-oxo-3H-purin-9-ium-2-olate CAS Name: 7,9-dimethyl-6-oxo-3H-purin-9-ium-2-olate IUPAC Name: 7,9-dimethyl-6-oxo-3H-purin-9-ium-2-olate Traditional Name: 6-keto-7,9-dimethyl-3H-purin-9-ium-2-olate Formula: C7H8N4O2 MolecularWeight: 180.16402

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C2=C1C(=O)N=C(N2)[O-])C

Isomeric SMILES

CN1C=[N+](C2=C1C(=O)N=C(N2)[O-])C

InChI

InChI=1S/C7H8N4O2/c1-10-3-11(2)5-4(10)6(12)9-7(13)8-5/h3H,1-2H3,(H-,8,9,12,13)