2-[(4-fluorophenyl)sulfonylamino]-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 2-[(4-fluorophenyl)sulfonylamino]-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2-[(4-fluorophenyl)sulfonylamino]-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 2-[(4-fluorophenyl)sulfonylamino]-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 2-[(4-fluorophenyl)sulfonylamino]-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2-[(4-fluorophenyl)sulfonylamino]-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C25H27FN3O3S+ MolecularWeight: 468.563583

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O3S/c26-21-11-13-22(14-12-21)33(31,32)28-24-6-2-1-5-23(24)25(30)27-17-19-7-9-20(10-8-19)18-29-15-3-4-16-29/h1-2,5-14,28H,3-4,15-18H2,(H,27,30)/p+1