(1-methylpyrrolidin-1-ium-1-yl)methyl 2-methylbutanoate chloride

Systemtic Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2-methylbutanoate chloride Openeye Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2-methylbutanoate chloride CAS Name: 2-methylbutanoic acid (1-methyl-1-pyrrolidin-1-iumyl)methyl ester chloride IUPAC Name: (1-methylpyrrolidin-1-ium-1-yl)methyl 2-methylbutanoate chloride Traditional Name: 2-methylbutyric acid (1-methylpyrrolidin-1-ium-1-yl)methyl ester chloride Formula: C11H22ClNO2 MolecularWeight: 235.75088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC[N+]1(CCCC1)C.[Cl-]

Isomeric SMILES

CCC(C)C(=O)OC[N+]1(CCCC1)C.[Cl-]

InChI

InChI=1S/C11H22NO2.ClH/c1-4-10(2)11(13)14-9-12(3)7-5-6-8-12;/h10H,4-9H2,1-3H3;1H/q+1;/p-1