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

Systemtic Name: 3,5-bis(chloranyl)-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]benzenesulfonamide Openeye Name: 3,5-dichloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]benzenesulfonamide CAS Name: 3,5-dichloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]benzenesulfonamide IUPAC Name: 3,5-dichloro-N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]benzenesulfonamide Traditional Name: 3,5-dichloro-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]benzenesulfonamide Formula: C16H16Cl2N3O4S2+ MolecularWeight: 449.35194

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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(=CC(=C3)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H15Cl2N3O4S2/c17-11-7-12(18)9-15(8-11)27(24,25)20-13-3-1-4-14(10-13)26(22,23)21-16-5-2-6-19-16/h1,3-4,7-10,20H,2,5-6H2,(H,19,21)/p+1