1-methylsulfonylsulfanyl-2,4-dinitro-benzene

Systemtic Name: 1-methylsulfonylsulfanyl-2,4-dinitro-benzene Openeye Name: 1-methylsulfonylsulfanyl-2,4-dinitro-benzene CAS Name: 1-(methylsulfonylthio)-2,4-dinitrobenzene IUPAC Name: 1-methylsulfonylsulfanyl-2,4-dinitrobenzene Traditional Name: 1-(mesylthio)-2,4-dinitro-benzene Formula: C7H6N2O6S2 MolecularWeight: 278.26234

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)SC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)SC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H6N2O6S2/c1-17(14,15)16-7-3-2-5(8(10)11)4-6(7)9(12)13/h2-4H,1H3