3-morpholin-4-ylsulfonyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-morpholin-4-ylsulfonyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-morpholinosulfonyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-(4-morpholinylsulfonyl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-morpholin-4-ylsulfonyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-morpholinosulfonyl-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C24H32N3O4S+ MolecularWeight: 458.59358

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C24H31N3O4S/c28-24(20-9-6-10-23(17-20)32(29,30)27-13-15-31-16-14-27)25-18-21-7-2-3-8-22(21)19-26-11-4-1-5-12-26/h2-3,6-10,17H,1,4-5,11-16,18-19H2,(H,25,28)/p+1