2-(3-ethanoylpyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-(3-ethanoylpyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C17H20N3O4S+ MolecularWeight: 362.4234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C[N+](=CC=C1)CC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC(=O)C1=C[N+](=CC=C1)CC(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H19N3O4S/c1-13(21)15-3-2-10-20(11-15)12-17(22)19-9-8-14-4-6-16(7-5-14)25(18,23)24/h2-7,10-11H,8-9,12H2,1H3,(H2-,18,19,22,23,24)/p+1