N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2-phenoxyethanoylamino)ethanamide

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2-phenoxyethanoylamino)ethanamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-[(2-phenoxyacetyl)amino]acetamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-[(1-oxo-2-phenoxyethyl)amino]acetamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-[(2-phenoxyacetyl)amino]acetamide Traditional Name: 2-[(2-phenoxyacetyl)amino]-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]acetamide Formula: C20H23N4O5S+ MolecularWeight: 431.48542

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CNC(=O)COC3=CC=CC=C3

Isomeric SMILES

C1CC(=[NH+]C1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)CNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O5S/c25-19(13-22-20(26)14-29-16-7-2-1-3-8-16)23-15-6-4-9-17(12-15)30(27,28)24-18-10-5-11-21-18/h1-4,6-9,12H,5,10-11,13-14H2,(H,21,24)(H,22,26)(H,23,25)/p+1