2-[3-(2-azanylethyl)-2-(2-methyloctan-2-yl)-4,5-dihydroimidazol-3-ium-1-yl]ethanol chloride

Systemtic Name: 2-[3-(2-azanylethyl)-2-(2-methyloctan-2-yl)-4,5-dihydroimidazol-3-ium-1-yl]ethanol chloride Openeye Name: 2-[3-(2-aminoethyl)-2-(1,1-dimethylheptyl)-4,5-dihydroimidazol-3-ium-1-yl]ethanol chloride CAS Name: 2-[3-(2-aminoethyl)-2-(2-methyloctan-2-yl)-4,5-dihydroimidazol-3-ium-1-yl]ethanol chloride IUPAC Name: 2-[3-(2-aminoethyl)-2-(2-methyloctan-2-yl)-4,5-dihydroimidazol-3-ium-1-yl]ethanol chloride Traditional Name: 2-[3-(2-aminoethyl)-2-(1,1-dimethylheptyl)-2-imidazolin-3-ium-1-yl]ethanol chloride Formula: C16H34ClN3O MolecularWeight: 319.91366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=[N+](CCN1CCO)CCN.[Cl-]

Isomeric SMILES

CCCCCCC(C)(C)C1=[N+](CCN1CCO)CCN.[Cl-]

InChI

InChI=1S/C16H34N3O.ClH/c1-4-5-6-7-8-16(2,3)15-18(10-9-17)11-12-19(15)13-14-20;/h20H,4-14,17H2,1-3H3;1H/q+1;/p-1