trimethyl-[2-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]oxyethyl]azanium

Systemtic Name: trimethyl-[2-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]oxyethyl]azanium Openeye Name: trimethyl-[2-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)oxyethyl]ammonium CAS Name: trimethyl-[2-[(1,3,7-trimethyl-2,6-dioxo-8-purinyl)oxy]ethyl]ammonium IUPAC Name: trimethyl-[2-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)oxyethyl]azanium Traditional Name: 2-(2,6-diketo-1,3,7-trimethyl-purin-8-yl)oxyethyl-trimethyl-ammonium Formula: C13H22N5O3+ MolecularWeight: 296.34548

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1OCC[N+](C)(C)C)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1OCC[N+](C)(C)C)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C13H22N5O3/c1-15-9-10(16(2)13(20)17(3)11(9)19)14-12(15)21-8-7-18(4,5)6/h7-8H2,1-6H3/q+1