2-azanyl-3-oxidanidyl-purin-3-ium-6-one

Systemtic Name: 2-azanyl-3-oxidanidyl-purin-3-ium-6-one Openeye Name: 2-amino-3-oxido-purin-3-ium-6-one CAS Name: 2-amino-3-oxido-6-purin-3-iumone IUPAC Name: 2-amino-3-oxidopurin-3-ium-6-one Traditional Name: 2-amino-3-oxido-purin-3-ium-6-one Formula: C5H3N5O2 MolecularWeight: 165.10962

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=[N+](C(=NC(=O)C2=N1)N)[O-]

Isomeric SMILES

C1=NC2=[N+](C(=NC(=O)C2=N1)N)[O-]

InChI

InChI=1S/C5H3N5O2/c6-5-9-4(11)2-3(10(5)12)8-1-7-2/h1H,(H2,6,9,11)