2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl-dimethyl-azanium Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl-dimethyl-ammonium CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethyl-dimethylammonium IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl-dimethylazanium Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)ethyl-dimethyl-ammonium Formula: C11H18N5O2+ MolecularWeight: 252.29292

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC[NH+](C)C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC[NH+](C)C

InChI

InChI=1S/C11H17N5O2/c1-13(2)5-6-16-7-12-9-8(16)10(17)15(4)11(18)14(9)3/h7H,5-6H2,1-4H3/p+1