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

Systemtic Name: 5-(dimethylsulfamoyl)-2-fluoranyl-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 5-(dimethylsulfamoyl)-2-fluoro-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 5-(dimethylsulfamoyl)-2-fluoro-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 5-(dimethylsulfamoyl)-2-fluoro-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 5-(dimethylsulfamoyl)-2-fluoro-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C21H27FN3O3S+ MolecularWeight: 420.520783

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)F)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCC3

InChI

InChI=1S/C21H26FN3O3S/c1-24(2)29(27,28)18-9-10-20(22)19(13-18)21(26)23-14-16-5-7-17(8-6-16)15-25-11-3-4-12-25/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,23,26)/p+1