N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(3-oxidanylpyridin-1-ium-1-yl)ethanamide Openeye Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(3-hydroxy-1-pyridin-1-iumyl)-N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(3-hydroxypyridin-1-ium-1-yl)-N-(4-methyl-3-piperidinosulfonyl-phenyl)acetamide Formula: C19H24N3O4S+ MolecularWeight: 390.47656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[N+]2=CC=CC(=C2)O)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[N+]2=CC=CC(=C2)O)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H23N3O4S/c1-15-7-8-16(20-19(24)14-21-9-5-6-17(23)13-21)12-18(15)27(25,26)22-10-3-2-4-11-22/h5-9,12-13H,2-4,10-11,14H2,1H3,(H-,20,23,24)/p+1