1-(methylsulfonylsulfanylmethyl)-4-nitro-benzene

Systemtic Name: 1-(methylsulfonylsulfanylmethyl)-4-nitro-benzene Openeye Name: 1-(methylsulfonylsulfanylmethyl)-4-nitro-benzene CAS Name: 1-[(methylsulfonylthio)methyl]-4-nitrobenzene IUPAC Name: 1-(methylsulfonylsulfanylmethyl)-4-nitrobenzene Traditional Name: 1-[(mesylthio)methyl]-4-nitro-benzene Formula: C8H9NO4S2 MolecularWeight: 247.29136

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)SCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)SCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C8H9NO4S2/c1-15(12,13)14-6-7-2-4-8(5-3-7)9(10)11/h2-5H,6H2,1H3