1-(4-chlorophenyl)carbonyl-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(4-chlorobenzoyl)-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-[4-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-N-[4-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]isonipecotamide Formula: C23H26ClN4O4S+ MolecularWeight: 489.99494

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H25ClN4O4S/c24-18-5-3-17(4-6-18)23(30)28-14-11-16(12-15-28)22(29)26-19-7-9-20(10-8-19)33(31,32)27-21-2-1-13-25-21/h3-10,16H,1-2,11-15H2,(H,25,27)(H,26,29)/p+1