N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]methanesulfonamide

Systemtic Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]methanesulfonamide Openeye Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]methanesulfonamide CAS Name: N-[1-methyl-2-(1-piperidin-1-iumylmethyl)-5-benzimidazolyl]methanesulfonamide IUPAC Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]methanesulfonamide Traditional Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]methanesulfonamide Formula: C15H23N4O2S+ MolecularWeight: 323.43372

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NS(=O)(=O)C)N=C1C[NH+]3CCCCC3

Isomeric SMILES

CN1C2=C(C=C(C=C2)NS(=O)(=O)C)N=C1C[NH+]3CCCCC3

InChI

InChI=1S/C15H22N4O2S/c1-18-14-7-6-12(17-22(2,20)21)10-13(14)16-15(18)11-19-8-4-3-5-9-19/h6-7,10,17H,3-5,8-9,11H2,1-2H3/p+1