4-(2-oxidanylidenepyrrolidin-1-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-(2-oxidanylidenepyrrolidin-1-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 4-(2-oxopyrrolidin-1-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-(2-oxo-1-pyrrolidinyl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-(2-oxopyrrolidin-1-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]benzenesulfonamide Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNS(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNS(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C23H29N3O3S/c27-23-9-6-16-26(23)21-10-12-22(13-11-21)30(28,29)24-17-19-7-2-3-8-20(19)18-25-14-4-1-5-15-25/h2-3,7-8,10-13,24H,1,4-6,9,14-18H2/p+1