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azanium 4-oxidanyl-5-oxidanylidene-cyclohepta-1,3,6-triene-1-sulfonate

azanium 4-oxidanyl-5-oxidanylidene-cyclohepta-1,3,6-triene-1-sulfonate

Systemtic Name:azanium 4-oxidanyl-5-oxidanylidene-cyclohepta-1,3,6-triene-1-sulfonate
Openeye Name:ammonium 4-hydroxy-5-oxo-cyclohepta-1,3,6-triene-1-sulfonate
CAS Name:ammonium 4-hydroxy-5-oxo-1-cyclohepta-1,3,6-trienesulfonate
IUPAC Name:azanium 4-hydroxy-5-oxocyclohepta-1,3,6-triene-1-sulfonate
Traditional Name:ammonium 4-hydroxy-5-keto-cyclohepta-1,3,6-triene-1-sulfonate
Formula: C7H9NO5S
MolecularWeight: 219.21506
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC=C1S(=O)(=O)[O-])O.[NH4+]


Isomeric SMILES

C1=CC(=O)C(=CC=C1S(=O)(=O)[O-])O.[NH4+]


InChI

InChI=1S/C7H6O5S.H3N/c8-6-3-1-5(13(10,11)12)2-4-7(6)9;/h1-4H,(H,8,9)(H,10,11,12);1H3


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