1-ethyl-N,N-dimethyl-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-ethyl-N,N-dimethyl-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]benzimidazole-5-sulfonamide Openeye Name: 1-ethyl-N,N-dimethyl-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]benzimidazole-5-sulfonamide CAS Name: 1-ethyl-N,N-dimethyl-2-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-ethyl-N,N-dimethyl-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]benzimidazole-5-sulfonamide Traditional Name: 1-ethyl-N,N-dimethyl-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]benzimidazole-5-sulfonamide Formula: C18H29N4O2S+ MolecularWeight: 365.51346

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1C[NH+]3CCCC(C3)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1C[NH+]3CCC[C@@H](C3)C

InChI

InChI=1S/C18H28N4O2S/c1-5-22-17-9-8-15(25(23,24)20(3)4)11-16(17)19-18(22)13-21-10-6-7-14(2)12-21/h8-9,11,14H,5-7,10,12-13H2,1-4H3/p+1/t14-/m0/s1