(4-ethyl-3-methyl-8-pentan-3-ylsulfonio-octan-4-yl)azanium diiodide

Systemtic Name: (4-ethyl-3-methyl-8-pentan-3-ylsulfonio-octan-4-yl)azanium diiodide Openeye Name: [1-ethyl-5-(1-ethylpropylsulfonio)-1-sec-butyl-pentyl]ammonium diiodide CAS Name: (4-ethyl-3-methyl-8-pentan-3-ylsulfoniooctan-4-yl)ammonium diiodide IUPAC Name: (4-ethyl-3-methyl-8-pentan-3-ylsulfoniooctan-4-yl)azanium diiodide Traditional Name: [1-ethyl-5-(1-ethylpropylsulfonio)-1-sec-butyl-pentyl]ammonium diiodide Formula: C16H37I2NS MolecularWeight: 529.34562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H35NS.2HI/c1-6-14(5)16(17,9-4)12-10-11-13-18-15(7-2)8-3;;/h14-15H,6-13,17H2,1-5H3;2*1H