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

Systemtic Name: 2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-1-yl]ethyl-dimethyl-propyl-azanium iodide Openeye Name: 2-(3,7-dimethyl-2,6-dioxo-purin-1-yl)ethyl-dimethyl-propyl-ammonium iodide CAS Name: 2-(3,7-dimethyl-2,6-dioxo-1-purinyl)ethyl-dimethyl-propylammonium iodide IUPAC Name: 2-(3,7-dimethyl-2,6-dioxopurin-1-yl)ethyl-dimethyl-propylazanium iodide Traditional Name: 2-(2,6-diketo-3,7-dimethyl-purin-1-yl)ethyl-dimethyl-propyl-ammonium iodide Formula: C14H24IN5O2 MolecularWeight: 421.27713

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C)(C)CCN1C(=O)C2=C(N=CN2C)N(C1=O)C.[I-]

Isomeric SMILES

CCC[N+](C)(C)CCN1C(=O)C2=C(N=CN2C)N(C1=O)C.[I-]

InChI

InChI=1S/C14H24N5O2.HI/c1-6-8-19(4,5)9-7-18-13(20)11-12(15-10-16(11)2)17(3)14(18)21;/h10H,6-9H2,1-5H3;1H/q+1;/p-1