(4-nitrophenyl)methylsulfanyl sulfate

Systemtic Name: (4-nitrophenyl)methylsulfanyl sulfate Openeye Name: (4-nitrophenyl)methylsulfanyl sulfate CAS Name: [(4-nitrophenyl)methylthio] sulfate IUPAC Name: (4-nitrophenyl)methylsulfanyl sulfate Traditional Name: [(4-nitrobenzyl)thio] sulfate Formula: C7H6NO6S2- MolecularWeight: 264.25564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSOS(=O)(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSOS(=O)(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H7NO6S2/c9-8(10)7-3-1-6(2-4-7)5-15-14-16(11,12)13/h1-4H,5H2,(H,11,12,13)/p-1