trimethyl-[2-(phenylmethyl)sulfonylethyl]azanium iodide

Systemtic Name: trimethyl-[2-(phenylmethyl)sulfonylethyl]azanium iodide Openeye Name: 2-benzylsulfonylethyl(trimethyl)ammonium iodide CAS Name: trimethyl-[2-(phenylmethyl)sulfonylethyl]ammonium iodide IUPAC Name: 2-benzylsulfonylethyl(trimethyl)azanium iodide Traditional Name: 2-benzylsulfonylethyl(trimethyl)ammonium iodide Formula: C12H20INO2S MolecularWeight: 369.26217

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCS(=O)(=O)CC1=CC=CC=C1.[I-]

Isomeric SMILES

C[N+](C)(C)CCS(=O)(=O)CC1=CC=CC=C1.[I-]

InChI

InChI=1S/C12H20NO2S.HI/c1-13(2,3)9-10-16(14,15)11-12-7-5-4-6-8-12;/h4-8H,9-11H2,1-3H3;1H/q+1;/p-1