(3-sulfooxy-2H-1,4-oxazin-6-yl) hydrogen sulfate

Systemtic Name: (3-sulfooxy-2H-1,4-oxazin-6-yl) hydrogen sulfate Openeye Name: (3-sulfooxy-2H-1,4-oxazin-6-yl) hydrogen sulfate CAS Name: sulfuric acid (3-sulfooxy-2H-1,4-oxazin-6-yl) ester IUPAC Name: (3-sulfooxy-2H-1,4-oxazin-6-yl) hydrogen sulfate Traditional Name: sulfuric acid (3-sulfoxy-2H-1,4-oxazin-6-yl) ester Formula: C4H5NO9S2 MolecularWeight: 275.2138

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC=C(O1)OS(=O)(=O)O)OS(=O)(=O)O

Isomeric SMILES

C1C(=NC=C(O1)OS(=O)(=O)O)OS(=O)(=O)O

InChI

InChI=1S/C4H5NO9S2/c6-15(7,8)13-3-2-12-4(1-5-3)14-16(9,10)11/h1H,2H2,(H,6,7,8)(H,9,10,11)