6-azanyl-3,9-dimethyl-2,7-dihydro-1H-purin-3-ium-8-one

Systemtic Name: 6-azanyl-3,9-dimethyl-2,7-dihydro-1H-purin-3-ium-8-one Openeye Name: 6-amino-3,9-dimethyl-2,7-dihydro-1H-purin-3-ium-8-one CAS Name: 6-amino-3,9-dimethyl-2,7-dihydro-1H-purin-3-ium-8-one IUPAC Name: 6-amino-3,9-dimethyl-2,7-dihydro-1H-purin-3-ium-8-one Traditional Name: 6-amino-3,9-dimethyl-2,7-dihydro-1H-purin-3-ium-8-one Formula: C7H12N5O+ MolecularWeight: 182.20308

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=[N+](CNC(=C2NC1=O)N)C

Isomeric SMILES

CN1C2=[N+](CNC(=C2NC1=O)N)C

InChI

InChI=1S/C7H11N5O/c1-11-3-9-5(8)4-6(11)12(2)7(13)10-4/h3H2,1-2H3,(H3,8,9,10,13)/p+1