(1-methylpyridin-1-ium-2-yl)methyl-pentan-3-yl-azanium diiodide

Systemtic Name: (1-methylpyridin-1-ium-2-yl)methyl-pentan-3-yl-azanium diiodide Openeye Name: 1-ethylpropyl-[(1-methylpyridin-1-ium-2-yl)methyl]ammonium diiodide CAS Name: (1-methyl-2-pyridin-1-iumyl)methyl-pentan-3-ylammonium diiodide IUPAC Name: (1-methylpyridin-1-ium-2-yl)methyl-pentan-3-ylazanium diiodide Traditional Name: 1-ethylpropyl-[(1-methylpyridin-1-ium-2-yl)methyl]ammonium diiodide Formula: C12H22I2N2 MolecularWeight: 448.12542

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC1=CC=CC=[N+]1C.[I-].[I-]

Isomeric SMILES

CCC(CC)[NH2+]CC1=CC=CC=[N+]1C.[I-].[I-]

InChI

InChI=1S/C12H21N2.2HI/c1-4-11(5-2)13-10-12-8-6-7-9-14(12)3;;/h6-9,11,13H,4-5,10H2,1-3H3;2*1H/q+1;;/p-1