(2,6-dimethylpyridin-1-ium-1-yl) 2-methylpropyl carbonate chloride

Systemtic Name: (2,6-dimethylpyridin-1-ium-1-yl) 2-methylpropyl carbonate chloride Openeye Name: (2,6-dimethylpyridin-1-ium-1-yl) isobutyl carbonate chloride CAS Name: carbonic acid (2,6-dimethyl-1-pyridin-1-iumyl) 2-methylpropyl ester chloride IUPAC Name: (2,6-dimethylpyridin-1-ium-1-yl) 2-methylpropyl carbonate chloride Traditional Name: carbonic acid (2,6-dimethylpyridin-1-ium-1-yl) isobutyl ester chloride Formula: C12H18ClNO3 MolecularWeight: 259.72922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CC=C1)C)OC(=O)OCC(C)C.[Cl-]

Isomeric SMILES

CC1=[N+](C(=CC=C1)C)OC(=O)OCC(C)C.[Cl-]

InChI

InChI=1S/C12H18NO3.ClH/c1-9(2)8-15-12(14)16-13-10(3)6-5-7-11(13)4;/h5-7,9H,8H2,1-4H3;1H/q+1;/p-1