2-methyl-5-[(4-methylphenyl)sulfamoyl]-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 2-methyl-5-[(4-methylphenyl)sulfamoyl]-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2-methyl-5-(p-tolylsulfamoyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 2-methyl-5-[(4-methylphenyl)sulfamoyl]-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 2-methyl-5-[(4-methylphenyl)sulfamoyl]-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2-methyl-5-(p-tolylsulfamoyl)-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C27H32N3O3S+ MolecularWeight: 478.62628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4

InChI

InChI=1S/C27H31N3O3S/c1-20-9-12-24(13-10-20)29-34(32,33)25-14-11-21(2)26(17-25)27(31)28-18-22-7-3-4-8-23(22)19-30-15-5-6-16-30/h3-4,7-14,17,29H,5-6,15-16,18-19H2,1-2H3,(H,28,31)/p+1