(2-methylsulfonyloxy-3-nitro-phenyl) methanesulfonate

Systemtic Name: (2-methylsulfonyloxy-3-nitro-phenyl) methanesulfonate Openeye Name: (2-methylsulfonyloxy-3-nitro-phenyl) methanesulfonate CAS Name: methanesulfonic acid (2-methylsulfonyloxy-3-nitrophenyl) ester IUPAC Name: (2-methylsulfonyloxy-3-nitrophenyl) methanesulfonate Traditional Name: methanesulfonic acid (2-methylsulfonyloxy-3-nitro-phenyl) ester Formula: C8H9NO8S2 MolecularWeight: 311.28896

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=CC(=C1OS(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OC1=CC=CC(=C1OS(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C8H9NO8S2/c1-18(12,13)16-7-5-3-4-6(9(10)11)8(7)17-19(2,14)15/h3-5H,1-2H3