2-[methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide

Systemtic Name: 2-[methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-oxidanylpyridin-1-ium-2-yl)ethanamide Openeye Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-[methyl(p-tolylsulfonyl)amino]acetamide CAS Name: N-(3-hydroxy-2-pyridin-1-iumyl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide IUPAC Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide Traditional Name: N-(3-hydroxypyridin-1-ium-2-yl)-2-[methyl(tosyl)amino]acetamide Formula: C15H18N3O4S+ MolecularWeight: 336.38612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=C(C=CC=[NH+]2)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=C(C=CC=[NH+]2)O

InChI

InChI=1S/C15H17N3O4S/c1-11-5-7-12(8-6-11)23(21,22)18(2)10-14(20)17-15-13(19)4-3-9-16-15/h3-9,19H,10H2,1-2H3,(H,16,17,20)/p+1