trisodium; 8-azanylnaphthalene-1-sulfonate; sulfur trioxide; sulfate

Systemtic Name: trisodium; 8-azanylnaphthalene-1-sulfonate; sulfur trioxide; sulfate Openeye Name: trisodium; 8-aminonaphthalene-1-sulfonate; sulfur trioxide; sulfate CAS Name: trisodium; 8-amino-1-naphthalenesulfonate; sulfur trioxide; sulfate IUPAC Name: trisodium; 8-aminonaphthalene-1-sulfonate; sulfur trioxide; sulfate Traditional Name: trisodium; 8-aminonaphthalene-1-sulfonate; sulfur trioxide; sulfate Formula: C10H8NNa3O16S5 MolecularWeight: 627.46193

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)N)C(=CC=C2)S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC2=C(C(=C1)N)C(=CC=C2)S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].O=S(=O)=O.O=S(=O)=O.O=S(=O)=O.[Na+].[Na+].[Na+]

InChI

InChI=1S/C10H9NO3S.3Na.H2O4S.3O3S/c11-8-5-1-3-7-4-2-6-9(10(7)8)15(12,13)14;;;;1-5(2,3)4;3*1-4(2)3/h1-6H,11H2,(H,12,13,14);;;;(H2,1,2,3,4);;;/q;3*+1;;;;/p-3