(3-ethyl-7-propylsulfonio-heptan-3-yl)azanium diiodide

Systemtic Name: (3-ethyl-7-propylsulfonio-heptan-3-yl)azanium diiodide Openeye Name: (1,1-diethyl-5-propylsulfonio-pentyl)ammonium diiodide CAS Name: (3-ethyl-7-propylsulfonioheptan-3-yl)ammonium diiodide IUPAC Name: (3-ethyl-7-propylsulfonioheptan-3-yl)azanium diiodide Traditional Name: (1,1-diethyl-5-propylsulfonio-pentyl)ammonium diiodide Formula: C12H29I2NS MolecularWeight: 473.2393

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Descriptors Computed from Structure

Canonical SMILES:

CCC[SH+]CCCCC(CC)(CC)[NH3+].[I-].[I-]

Isomeric SMILES

CCC[SH+]CCCCC(CC)(CC)[NH3+].[I-].[I-]

InChI

InChI=1S/C12H27NS.2HI/c1-4-10-14-11-8-7-9-12(13,5-2)6-3;;/h4-11,13H2,1-3H3;2*1H