4-morpholin-4-ylsulfonyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-morpholin-4-ylsulfonyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzenesulfonamide Openeye Name: 4-morpholinosulfonyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-(4-morpholinylsulfonyl)-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-morpholin-4-ylsulfonyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-morpholinosulfonyl-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzenesulfonamide Formula: C22H30N3O5S2+ MolecularWeight: 480.6207

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H29N3O5S2/c26-31(27,23-17-19-5-1-2-6-20(19)18-24-11-3-4-12-24)21-7-9-22(10-8-21)32(28,29)25-13-15-30-16-14-25/h1-2,5-10,23H,3-4,11-18H2/p+1