4-chloranyl-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: 4-chloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: 4-chloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: 4-chloro-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C17H16ClF3N3O4S2+ MolecularWeight: 482.90485

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C17H15ClF3N3O4S2/c18-15-7-6-13(10-14(15)17(19,20)21)29(25,26)23-11-3-1-4-12(9-11)30(27,28)24-16-5-2-8-22-16/h1,3-4,6-7,9-10,23H,2,5,8H2,(H,22,24)/p+1