2-[4,7-dimethyl-1,3-bis(oxidanylidene)purino[7,8-a]imidazol-6-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[4,7-dimethyl-1,3-bis(oxidanylidene)purino[7,8-a]imidazol-6-yl]ethyl-dimethyl-azanium Openeye Name: 2-(4,7-dimethyl-1,3-dioxo-purino[7,8-a]imidazol-6-yl)ethyl-dimethyl-ammonium CAS Name: 2-(4,7-dimethyl-1,3-dioxo-6-purino[7,8-a]imidazolyl)ethyl-dimethylammonium IUPAC Name: 2-(4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-6-yl)ethyl-dimethylazanium Traditional Name: 2-(1,3-diketo-4,7-dimethyl-purin[7,8-a]imidazol-6-yl)ethyl-dimethyl-ammonium Formula: C13H19N6O2+ MolecularWeight: 291.32896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CC[NH+](C)C)N(C(=O)NC3=O)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CC[NH+](C)C)N(C(=O)NC3=O)C

InChI

InChI=1S/C13H18N6O2/c1-8-7-19-9-10(17(4)13(21)15-11(9)20)14-12(19)18(8)6-5-16(2)3/h7H,5-6H2,1-4H3,(H,15,20,21)/p+1