N-[2-methoxy-4-(methylsulfonylamino)-5-oxidanyl-phenyl]-2-pyridin-1-ium-1-yl-ethanamide

Systemtic Name: N-[2-methoxy-4-(methylsulfonylamino)-5-oxidanyl-phenyl]-2-pyridin-1-ium-1-yl-ethanamide Openeye Name: N-[5-hydroxy-4-(methanesulfonamido)-2-methoxy-phenyl]-2-pyridin-1-ium-1-yl-acetamide CAS Name: N-[5-hydroxy-4-(methanesulfonamido)-2-methoxyphenyl]-2-(1-pyridin-1-iumyl)acetamide IUPAC Name: N-[5-hydroxy-4-(methanesulfonamido)-2-methoxyphenyl]-2-pyridin-1-ium-1-ylacetamide Traditional Name: N-[5-hydroxy-4-(methanesulfonamido)-2-methoxy-phenyl]-2-pyridin-1-ium-1-yl-acetamide Formula: C15H18N3O5S+ MolecularWeight: 352.38552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C[N+]2=CC=CC=C2)O)NS(=O)(=O)C

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C[N+]2=CC=CC=C2)O)NS(=O)(=O)C

InChI

InChI=1S/C15H17N3O5S/c1-23-14-9-11(17-24(2,21)22)13(19)8-12(14)16-15(20)10-18-6-4-3-5-7-18/h3-9,17H,10H2,1-2H3,(H-,16,19,20)/p+1