tetraoxidanium; 1,1-bis(oxidanylidene)-1,2-benzothiazol-2-id-3-one; iron(2+)

Systemtic Name: tetraoxidanium; 1,1-bis(oxidanylidene)-1,2-benzothiazol-2-id-3-one; iron(2+) Openeye Name: ferrous tetraoxonium 1,1-dioxo-1,2-benzothiazol-2-id-3-one CAS Name: tetraoxonium; 1,1-dioxo-1,2-benzothiazol-2-id-3-one; iron(2+) IUPAC Name: tetraoxidanium; 1,1-dioxo-1,2-benzothiazol-2-id-3-one; iron(2+) Traditional Name: ferrous tetraoxonium 1,1-diketo-1,2-benzothiazol-2-id-3-one Formula: C14H20FeN2O10S2+4 MolecularWeight: 496.291

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.[OH3+].[OH3+].[OH3+].[OH3+].[Fe+2]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.[OH3+].[OH3+].[OH3+].[OH3+].[Fe+2]

InChI

InChI=1S/2C7H5NO3S.Fe.4H2O/c2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;;;;;/h2*1-4H,(H,8,9);;4*1H2/q;;+2;;;;/p+2