ethyl 2-(4,5-dimethyl-1,2,3,4-tetrazol-4-ium-1-yl)-2-methyl-butanoate iodide

Systemtic Name: ethyl 2-(4,5-dimethyl-1,2,3,4-tetrazol-4-ium-1-yl)-2-methyl-butanoate iodide Openeye Name: ethyl 2-(4,5-dimethyltetrazol-4-ium-1-yl)-2-methyl-butanoate iodide CAS Name: 2-(4,5-dimethyl-1-tetrazol-4-iumyl)-2-methylbutanoic acid ethyl ester iodide IUPAC Name: ethyl 2-(4,5-dimethyltetrazol-4-ium-1-yl)-2-methylbutanoate iodide Traditional Name: 2-(4,5-dimethyltetrazol-4-ium-1-yl)-2-methyl-butyric acid ethyl ester iodide Formula: C10H19IN4O2 MolecularWeight: 354.18793

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)OCC)N1C(=[N+](N=N1)C)C.[I-]

Isomeric SMILES

CCC(C)(C(=O)OCC)N1C(=[N+](N=N1)C)C.[I-]

InChI

InChI=1S/C10H19N4O2.HI/c1-6-10(4,9(15)16-7-2)14-8(3)13(5)11-12-14;/h6-7H2,1-5H3;1H/q+1;/p-1