(3-azaniumyl-4-sulfo-phenyl)azanium sulfate

Systemtic Name: (3-azaniumyl-4-sulfo-phenyl)azanium sulfate Openeye Name: (3-azaniumyl-4-sulfo-phenyl)ammonium sulfate CAS Name: (3-ammonio-4-sulfophenyl)ammonium sulfate IUPAC Name: (3-azaniumyl-4-sulfophenyl)azanium sulfate Traditional Name: (3-ammonio-4-sulfo-phenyl)ammonium sulfate Formula: C6H10N2O7S2 MolecularWeight: 286.2828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[NH3+])[NH3+])S(=O)(=O)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[NH3+])[NH3+])S(=O)(=O)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C6H8N2O3S.H2O4S/c7-4-1-2-6(5(8)3-4)12(9,10)11;1-5(2,3)4/h1-3H,7-8H2,(H,9,10,11);(H2,1,2,3,4)