4-chloranyl-3-(methylsulfamoyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-chloranyl-3-(methylsulfamoyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-chloro-3-(methylsulfamoyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-chloro-3-(methylsulfamoyl)-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-chloro-3-(methylsulfamoyl)-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-chloro-3-(methylsulfamoyl)-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3)Cl

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3)Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-22-28(26,27)19-12-15(8-9-18(19)21)20(25)23-13-16-6-2-3-7-17(16)14-24-10-4-5-11-24/h2-3,6-9,12,22H,4-5,10-11,13-14H2,1H3,(H,23,25)/p+1