5-(dimethylsulfamoyl)-N-[2-(1-methylazepan-1-ium-1-yl)ethyl]furan-2-carboxamide iodide

Systemtic Name: 5-(dimethylsulfamoyl)-N-[2-(1-methylazepan-1-ium-1-yl)ethyl]furan-2-carboxamide iodide Openeye Name: 5-(dimethylsulfamoyl)-N-[2-(1-methylazepan-1-ium-1-yl)ethyl]furan-2-carboxamide iodide CAS Name: 5-(dimethylsulfamoyl)-N-[2-(1-methyl-1-azepan-1-iumyl)ethyl]-2-furancarboxamide iodide IUPAC Name: 5-(dimethylsulfamoyl)-N-[2-(1-methylazepan-1-ium-1-yl)ethyl]furan-2-carboxamide iodide Traditional Name: 5-(dimethylsulfamoyl)-N-[2-(1-methylazepan-1-ium-1-yl)ethyl]-2-furamide iodide Formula: C16H28IN3O4S MolecularWeight: 485.38069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(O1)C(=O)NCC[N+]2(CCCCCC2)C.[I-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(O1)C(=O)NCC[N+]2(CCCCCC2)C.[I-]

InChI

InChI=1S/C16H27N3O4S.HI/c1-18(2)24(21,22)15-9-8-14(23-15)16(20)17-10-13-19(3)11-6-4-5-7-12-19;/h8-9H,4-7,10-13H2,1-3H3;1H