dipotassium (4-nitro-2-oxidanidyl-phenyl) sulfate dihydrate

Systemtic Name: dipotassium (4-nitro-2-oxidanidyl-phenyl) sulfate dihydrate Openeye Name: dipotassium (4-nitro-2-oxido-phenyl) sulfate dihydrate CAS Name: dipotassium (4-nitro-2-oxidophenyl) sulfate dihydrate IUPAC Name: dipotassium (4-nitro-2-oxidophenyl) sulfate dihydrate Traditional Name: dipotassium (4-nitro-2-oxido-phenyl) sulfate dihydrate Formula: C6H7K2NO9S MolecularWeight: 347.38268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[O-])OS(=O)(=O)[O-].O.O.[K+].[K+]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[O-])OS(=O)(=O)[O-].O.O.[K+].[K+]

InChI

InChI=1S/C6H5NO7S.2K.2H2O/c8-5-3-4(7(9)10)1-2-6(5)14-15(11,12)13;;;;/h1-3,8H,(H,11,12,13);;;2*1H2/q;2*+1;;/p-2