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

Systemtic Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]benzenesulfonamide Formula: C22H28N3O4S+ MolecularWeight: 430.54042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4

InChI

InChI=1S/C22H27N3O4S/c26-22-6-3-11-25(22)20-7-9-21(10-8-20)30(27,28)23-16-18-4-1-2-5-19(18)17-24-12-14-29-15-13-24/h1-2,4-5,7-10,23H,3,6,11-17H2/p+1