sodium 2-(1,3-benzoxazol-2-yl)-1-oxidanyl-3-oxidanylidene-propane-1-sulfonate

Systemtic Name: sodium 2-(1,3-benzoxazol-2-yl)-1-oxidanyl-3-oxidanylidene-propane-1-sulfonate Openeye Name: sodium 2-(1,3-benzoxazol-2-yl)-1-hydroxy-3-oxo-propane-1-sulfonate CAS Name: sodium 2-(1,3-benzoxazol-2-yl)-1-hydroxy-3-oxo-1-propanesulfonate IUPAC Name: sodium 2-(1,3-benzoxazol-2-yl)-1-hydroxy-3-oxopropane-1-sulfonate Traditional Name: sodium 2-(1,3-benzoxazol-2-yl)-1-hydroxy-3-keto-propane-1-sulfonate Formula: C10H8NNaO6S MolecularWeight: 293.22839

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C(C=O)C(O)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C(C=O)C(O)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H9NO6S.Na/c12-5-6(10(13)18(14,15)16)9-11-7-3-1-2-4-8(7)17-9;/h1-6,10,13H,(H,14,15,16);/q;+1/p-1