1-ethyl-N,N,2,3-tetramethyl-benzimidazol-1-ium-5-sulfonamide iodide

Systemtic Name: 1-ethyl-N,N,2,3-tetramethyl-benzimidazol-1-ium-5-sulfonamide iodide Openeye Name: 1-ethyl-N,N,2,3-tetramethyl-benzimidazol-1-ium-5-sulfonamide iodide CAS Name: 1-ethyl-N,N,2,3-tetramethyl-5-benzimidazol-1-iumsulfonamide iodide IUPAC Name: 1-ethyl-N,N,2,3-tetramethylbenzimidazol-1-ium-5-sulfonamide iodide Traditional Name: 1-ethyl-N,N,2,3-tetramethyl-benzimidazol-1-ium-5-sulfonamide iodide Formula: C13H20IN3O2S MolecularWeight: 409.28627

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N(C2=C1C=CC(=C2)S(=O)(=O)N(C)C)C)C.[I-]

Isomeric SMILES

CC[N+]1=C(N(C2=C1C=CC(=C2)S(=O)(=O)N(C)C)C)C.[I-]

InChI

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