4-diethylsulfoniobutyl-ethyl-dimethyl-azanium diiodide

Systemtic Name: 4-diethylsulfoniobutyl-ethyl-dimethyl-azanium diiodide Openeye Name: 4-diethylsulfoniobutyl-ethyl-dimethyl-ammonium diiodide CAS Name: 4-diethylsulfoniobutyl-ethyl-dimethylammonium diiodide IUPAC Name: 4-diethylsulfoniobutyl-ethyl-dimethylazanium diiodide Traditional Name: 4-diethylsulfoniobutyl-ethyl-dimethyl-ammonium diiodide Formula: C12H29I2NS MolecularWeight: 473.2393

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)CCCC[S+](CC)CC.[I-].[I-]

Isomeric SMILES

CC[N+](C)(C)CCCC[S+](CC)CC.[I-].[I-]

InChI

InChI=1S/C12H29NS.2HI/c1-6-13(4,5)11-9-10-12-14(7-2)8-3;;/h6-12H2,1-5H3;2*1H/q+2;;/p-2