1,3-diethyl-N,2-dimethyl-benzimidazol-1-ium-5-sulfonamide iodide

Systemtic Name: 1,3-diethyl-N,2-dimethyl-benzimidazol-1-ium-5-sulfonamide iodide Openeye Name: 1,3-diethyl-N,2-dimethyl-benzimidazol-1-ium-5-sulfonamide iodide CAS Name: 1,3-diethyl-N,2-dimethyl-5-benzimidazol-1-iumsulfonamide iodide IUPAC Name: 1,3-diethyl-N,2-dimethylbenzimidazol-1-ium-5-sulfonamide iodide Traditional Name: 1,3-diethyl-N,2-dimethyl-benzimidazol-1-ium-5-sulfonamide iodide Formula: C13H20IN3O2S MolecularWeight: 409.28627

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C2=C1C=C(C=C2)S(=O)(=O)NC)CC)C.[I-]

Isomeric SMILES

CCN1C(=[N+](C2=C1C=C(C=C2)S(=O)(=O)NC)CC)C.[I-]

InChI

InChI=1S/C13H20N3O2S.HI/c1-5-15-10(3)16(6-2)13-9-11(7-8-12(13)15)19(17,18)14-4;/h7-9,14H,5-6H2,1-4H3;1H/q+1;/p-1