2-(3-oxidanylpyridin-1-ium-1-yl)-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3-oxidanylpyridin-1-ium-1-yl)-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-[3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(3-hydroxy-1-pyridin-1-iumyl)-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(3-piperidinosulfonylphenyl)acetamide Formula: C18H22N3O4S+ MolecularWeight: 376.44998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C[N+]3=CC=CC(=C3)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C[N+]3=CC=CC(=C3)O

InChI

InChI=1S/C18H21N3O4S/c22-16-7-5-9-20(13-16)14-18(23)19-15-6-4-8-17(12-15)26(24,25)21-10-2-1-3-11-21/h4-9,12-13H,1-3,10-11,14H2,(H-,19,22,23)/p+1