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

Systemtic Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2,3-dimethylphenoxy)ethanamide Openeye Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2,3-dimethylphenoxy)acetamide CAS Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2,3-dimethylphenoxy)acetamide IUPAC Name: N-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-2-(2,3-dimethylphenoxy)acetamide Traditional Name: 2-(2,3-dimethylphenoxy)-N-[3-(1-pyrrolin-1-ium-2-ylsulfamoyl)phenyl]acetamide Formula: C20H24N3O4S+ MolecularWeight: 402.48726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=[NH+]CCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=[NH+]CCC3)C

InChI

InChI=1S/C20H23N3O4S/c1-14-6-3-9-18(15(14)2)27-13-20(24)22-16-7-4-8-17(12-16)28(25,26)23-19-10-5-11-21-19/h3-4,6-9,12H,5,10-11,13H2,1-2H3,(H,21,23)(H,22,24)/p+1