(1-methylpyridin-1-ium-3-yl)methyl 4-[[butyl(dimethyl)silyl]methoxy]benzoate iodide

Systemtic Name: (1-methylpyridin-1-ium-3-yl)methyl 4-[[butyl(dimethyl)silyl]methoxy]benzoate iodide Openeye Name: (1-methylpyridin-1-ium-3-yl)methyl 4-[[butyl(dimethyl)silyl]methoxy]benzoate iodide CAS Name: 4-[[butyl(dimethyl)silyl]methoxy]benzoic acid (1-methyl-3-pyridin-1-iumyl)methyl ester iodide IUPAC Name: (1-methylpyridin-1-ium-3-yl)methyl 4-[[butyl(dimethyl)silyl]methoxy]benzoate iodide Traditional Name: 4-[[butyl(dimethyl)silyl]methoxy]benzoic acid (1-methylpyridin-1-ium-3-yl)methyl ester iodide Formula: C21H30INO3Si MolecularWeight: 499.45777

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Si](C)(C)COC1=CC=C(C=C1)C(=O)OCC2=C[N+](=CC=C2)C.[I-]

Isomeric SMILES

CCCC[Si](C)(C)COC1=CC=C(C=C1)C(=O)OCC2=C[N+](=CC=C2)C.[I-]

InChI

InChI=1S/C21H30NO3Si.HI/c1-5-6-14-26(3,4)17-25-20-11-9-19(10-12-20)21(23)24-16-18-8-7-13-22(2)15-18;/h7-13,15H,5-6,14,16-17H2,1-4H3;1H/q+1;/p-1