2-ethyl-3-(1-methylpyrrolidin-1-ium-1-yl)-3-propyl-thietane 1-oxide chloride

Systemtic Name: 2-ethyl-3-(1-methylpyrrolidin-1-ium-1-yl)-3-propyl-thietane 1-oxide chloride Openeye Name: 2-ethyl-3-(1-methylpyrrolidin-1-ium-1-yl)-3-propyl-thietane 1-oxide chloride CAS Name: 2-ethyl-3-(1-methyl-1-pyrrolidin-1-iumyl)-3-propylthietane 1-oxide chloride IUPAC Name: 2-ethyl-3-(1-methylpyrrolidin-1-ium-1-yl)-3-propylthietane 1-oxide chloride Traditional Name: 2-ethyl-3-(1-methylpyrrolidin-1-ium-1-yl)-3-propyl-thietane 1-oxide chloride Formula: C13H26ClNOS MolecularWeight: 279.86964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CS(=O)C1CC)[N+]2(CCCC2)C.[Cl-]

Isomeric SMILES

CCCC1(CS(=O)C1CC)[N+]2(CCCC2)C.[Cl-]

InChI

InChI=1S/C13H26NOS.ClH/c1-4-8-13(11-16(15)12(13)5-2)14(3)9-6-7-10-14;/h12H,4-11H2,1-3H3;1H/q+1;/p-1