tetraoxidanium; cobalt(2+); 6-nitro-1,2$l^{6},3-benzoxathiazol-3-ide 2,2-dioxide

Systemtic Name: tetraoxidanium; cobalt(2+); 6-nitro-1,2$l^{6},3-benzoxathiazol-3-ide 2,2-dioxide Openeye Name: cobaltous tetraoxonium 6-nitro-1,2$l^{6},3-benzoxathiazol-3-ide 2,2-dioxide CAS Name: tetraoxonium; cobalt(2+); 6-nitro-1,2$l^{6},3-benzoxathiazol-3-ide 2,2-dioxide IUPAC Name: tetraoxidanium; cobalt(2+); 6-nitro-1,2$l^{6},3-benzoxathiazol-3-ide 2,2-dioxide Traditional Name: cobaltous tetraoxonium 6-nitro-1,2$l^{6},3-benzoxathiazol-3-ide 2,2-dioxide Formula: C12H18CoN4O14S2+4 MolecularWeight: 565.35292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])OS(=O)(=O)[N-]2.C1=CC2=C(C=C1[N+](=O)[O-])OS(=O)(=O)[N-]2.[OH3+].[OH3+].[OH3+].[OH3+].[Co+2]

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])OS(=O)(=O)[N-]2.C1=CC2=C(C=C1[N+](=O)[O-])OS(=O)(=O)[N-]2.[OH3+].[OH3+].[OH3+].[OH3+].[Co+2]

InChI

InChI=1S/2C6H3N2O5S.Co.4H2O/c2*9-8(10)4-1-2-5-6(3-4)13-14(11,12)7-5;;;;;/h2*1-3H;;4*1H2/q2*-1;+2;;;;/p+4