[3-(methylsulfonyloxymethyl)-5-nitro-phenyl]methyl methanesulfonate

Systemtic Name: [3-(methylsulfonyloxymethyl)-5-nitro-phenyl]methyl methanesulfonate Openeye Name: [3-(methylsulfonyloxymethyl)-5-nitro-phenyl]methyl methanesulfonate CAS Name: methanesulfonic acid [3-(methylsulfonyloxymethyl)-5-nitrophenyl]methyl ester IUPAC Name: [3-(methylsulfonyloxymethyl)-5-nitrophenyl]methyl methanesulfonate Traditional Name: methanesulfonic acid [3-(methylsulfonyloxymethyl)-5-nitro-benzyl] ester Formula: C10H13NO8S2 MolecularWeight: 339.34212

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1=CC(=CC(=C1)[N+](=O)[O-])COS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OCC1=CC(=CC(=C1)[N+](=O)[O-])COS(=O)(=O)C

InChI

InChI=1S/C10H13NO8S2/c1-20(14,15)18-6-8-3-9(7-19-21(2,16)17)5-10(4-8)11(12)13/h3-5H,6-7H2,1-2H3