2-[3,4-dimethoxy-2,5,6-tris(methylsulfanyl)phenyl]ethyl-trimethyl-azanium iodide

Systemtic Name: 2-[3,4-dimethoxy-2,5,6-tris(methylsulfanyl)phenyl]ethyl-trimethyl-azanium iodide Openeye Name: 2-[3,4-dimethoxy-2,5,6-tris(methylsulfanyl)phenyl]ethyl-trimethyl-ammonium iodide CAS Name: 2-[3,4-dimethoxy-2,5,6-tris(methylthio)phenyl]ethyl-trimethylammonium iodide IUPAC Name: 2-[3,4-dimethoxy-2,5,6-tris(methylsulfanyl)phenyl]ethyl-trimethylazanium iodide Traditional Name: 2-[3,4-dimethoxy-2,5,6-tris(methylthio)phenyl]ethyl-trimethyl-ammonium iodide Formula: C16H28INO2S3 MolecularWeight: 489.49849

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCC1=C(C(=C(C(=C1SC)SC)OC)OC)SC.[I-]

Isomeric SMILES

C[N+](C)(C)CCC1=C(C(=C(C(=C1SC)SC)OC)OC)SC.[I-]

InChI

InChI=1S/C16H28NO2S3.HI/c1-17(2,3)10-9-11-14(20-6)12(18-4)13(19-5)16(22-8)15(11)21-7;/h9-10H2,1-8H3;1H/q+1;/p-1