N-(3-oxidanylpyridin-1-ium-2-yl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-(3-oxidanylpyridin-1-ium-2-yl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-(3-hydroxypyridin-1-ium-2-yl)-5-(2-thienyl)isoxazole-3-carboxamide CAS Name: N-(3-hydroxy-2-pyridin-1-iumyl)-5-thiophen-2-yl-3-isoxazolecarboxamide IUPAC Name: N-(3-hydroxypyridin-1-ium-2-yl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-(3-hydroxypyridin-1-ium-2-yl)-5-(2-thienyl)isoxazole-3-carboxamide Formula: C13H10N3O3S+ MolecularWeight: 288.3018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C([NH+]=C1)NC(=O)C2=NOC(=C2)C3=CC=CS3)O

Isomeric SMILES

C1=CC(=C([NH+]=C1)NC(=O)C2=NOC(=C2)C3=CC=CS3)O

InChI

InChI=1S/C13H9N3O3S/c17-9-3-1-5-14-12(9)15-13(18)8-7-10(19-16-8)11-4-2-6-20-11/h1-7,17H,(H,14,15,18)/p+1