sodium; ethanoylazanide; [2-(4-hydroxyphenyl)-4-oxidanyl-3-oxidanylidene-1,2-oxazolidin-2-ium-2-yl] 5-oxidanylideneoxolane-2-carboxylate

Systemtic Name: sodium; ethanoylazanide; [2-(4-hydroxyphenyl)-4-oxidanyl-3-oxidanylidene-1,2-oxazolidin-2-ium-2-yl] 5-oxidanylideneoxolane-2-carboxylate Openeye Name: sodium; acetylazanide; [4-hydroxy-2-(4-hydroxyphenyl)-3-oxo-isoxazolidin-2-ium-2-yl] 5-oxotetrahydrofuran-2-carboxylate CAS Name: sodium; acetylazanide; 5-oxo-2-oxolanecarboxylic acid [4-hydroxy-2-(4-hydroxyphenyl)-3-oxo-2-isoxazolidin-2-iumyl] ester IUPAC Name: sodium; acetylazanide; [4-hydroxy-2-(4-hydroxyphenyl)-3-oxo-1,2-oxazolidin-2-ium-2-yl] 5-oxooxolane-2-carboxylate Traditional Name: sodium; acetylazanide; 5-ketotetrahydrofuran-2-carboxylic acid [4-hydroxy-2-(4-hydroxyphenyl)-3-keto-isoxazolidin-2-ium-2-yl] ester Formula: C16H18N2NaO9+ MolecularWeight: 405.31189

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[NH-].C1CC(=O)OC1C(=O)O[N+]2(C(=O)C(CO2)O)C3=CC=C(C=C3)O.[Na+]

Isomeric SMILES

CC(=O)[NH-].C1CC(=O)OC1C(=O)O[N+]2(C(=O)C(CO2)O)C3=CC=C(C=C3)O.[Na+]

InChI

InChI=1S/C14H13NO8.C2H5NO.Na/c16-9-3-1-8(2-4-9)15(13(19)10(17)7-21-15)23-14(20)11-5-6-12(18)22-11;1-2(3)4;/h1-4,10-11,17H,5-7H2;1H3,(H2,3,4);/q;;+1