1-methyl-3-(2-nitropropan-2-yl)pyrazin-1-ium iodide

Systemtic Name: 1-methyl-3-(2-nitropropan-2-yl)pyrazin-1-ium iodide Openeye Name: 1-methyl-3-(1-methyl-1-nitro-ethyl)pyrazin-1-ium iodide CAS Name: 1-methyl-3-(2-nitropropan-2-yl)pyrazin-1-ium iodide IUPAC Name: 1-methyl-3-(2-nitropropan-2-yl)pyrazin-1-ium iodide Traditional Name: 1-methyl-3-(1-methyl-1-nitro-ethyl)pyrazin-1-ium iodide Formula: C8H12IN3O2 MolecularWeight: 309.10425

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NC=C[N+](=C1)C)[N+](=O)[O-].[I-]

Isomeric SMILES

CC(C)(C1=NC=C[N+](=C1)C)[N+](=O)[O-].[I-]

InChI

InChI=1S/C8H12N3O2.HI/c1-8(2,11(12)13)7-6-10(3)5-4-9-7;/h4-6H,1-3H3;1H/q+1;/p-1