barium(2+); 5,7-dinitro-8-oxidanidyl-naphthalene-2-sulfonate

Systemtic Name: barium(2+); 5,7-dinitro-8-oxidanidyl-naphthalene-2-sulfonate Openeye Name: barium(2+); 5,7-dinitro-8-oxido-naphthalene-2-sulfonate CAS Name: barium(2+); 5,7-dinitro-8-oxido-2-naphthalenesulfonate IUPAC Name: barium(2+); 5,7-dinitro-8-oxidonaphthalene-2-sulfonate Traditional Name: barium(2+); 5,7-dinitro-8-oxido-naphthalene-2-sulfonate Formula: C10H4BaN2O8S MolecularWeight: 449.53936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].[Ba+2]

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)[O-])C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[O-].[Ba+2]

InChI

InChI=1S/C10H6N2O8S.Ba/c13-10-7-3-5(21(18,19)20)1-2-6(7)8(11(14)15)4-9(10)12(16)17;/h1-4,13H,(H,18,19,20);/q;+2/p-2