2-azanyl-1,7,9-trimethyl-purin-9-ium-6-one

Systemtic Name: 2-azanyl-1,7,9-trimethyl-purin-9-ium-6-one Openeye Name: 2-amino-1,7,9-trimethyl-purin-9-ium-6-one CAS Name: 2-amino-1,7,9-trimethyl-6-purin-9-iumone IUPAC Name: 2-amino-1,7,9-trimethylpurin-9-ium-6-one Traditional Name: 2-amino-1,7,9-trimethyl-purin-9-ium-6-one Formula: C8H12N5O+ MolecularWeight: 194.21378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N5O/c1-11-4-12(2)6-5(11)7(14)13(3)8(9)10-6/h4H,1-3H3,(H-,9,10,14)/p+1