1,3-diethyl-2-methyl-benzimidazol-1-ium-5-sulfonamide

Systemtic Name: 1,3-diethyl-2-methyl-benzimidazol-1-ium-5-sulfonamide Openeye Name: 1,3-diethyl-2-methyl-benzimidazol-1-ium-5-sulfonamide CAS Name: 1,3-diethyl-2-methyl-5-benzimidazol-1-iumsulfonamide IUPAC Name: 1,3-diethyl-2-methylbenzimidazol-1-ium-5-sulfonamide Traditional Name: 1,3-diethyl-2-methyl-benzimidazol-1-ium-5-sulfonamide Formula: C12H18N3O2S+ MolecularWeight: 268.35522

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+](C2=C1C=C(C=C2)S(=O)(=O)N)CC)C

Isomeric SMILES

CCN1C(=[N+](C2=C1C=C(C=C2)S(=O)(=O)N)CC)C

InChI

InChI=1S/C12H18N3O2S/c1-4-14-9(3)15(5-2)12-8-10(18(13,16)17)6-7-11(12)14/h6-8H,4-5H2,1-3H3,(H2,13,16,17)/q+1