pentadecylsulfonyl-[5-(triethylazaniumyl)pentan-2-yl]azanide hydroiodide

Systemtic Name: pentadecylsulfonyl-[5-(triethylazaniumyl)pentan-2-yl]azanide hydroiodide Openeye Name: [1-methyl-4-(triethylammonio)butyl]-pentadecylsulfonyl-azanide hydroiodide CAS Name: pentadecylsulfonyl-[5-(triethylammonio)pentan-2-yl]azanide hydroiodide IUPAC Name: pentadecylsulfonyl-[5-(triethylazaniumyl)pentan-2-yl]azanide hydroiodide Traditional Name: [1-methyl-4-(triethylammonio)butyl]-pentadecylsulfonyl-azanide hydroiodide Formula: C26H57IN2O2S MolecularWeight: 588.71245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCS(=O)(=O)[N-]C(C)CCC[N+](CC)(CC)CC.I

Isomeric SMILES

CCCCCCCCCCCCCCCS(=O)(=O)[N-]C(C)CCC[N+](CC)(CC)CC.I

InChI

InChI=1S/C26H56N2O2S.HI/c1-6-10-11-12-13-14-15-16-17-18-19-20-21-25-31(29,30)27-26(5)23-22-24-28(7-2,8-3)9-4;/h26H,6-25H2,1-5H3;1H