2-(3-ethanoylpyridin-1-ium-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3-ethanoylpyridin-1-ium-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C19H22N3O4S+ MolecularWeight: 388.46068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C[N+](=CC=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(=O)C1=C[N+](=CC=C1)CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H21N3O4S/c1-15(23)16-6-5-9-21(13-16)14-19(24)20-17-7-4-8-18(12-17)27(25,26)22-10-2-3-11-22/h4-9,12-13H,2-3,10-11,14H2,1H3/p+1