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

Systemtic Name: [4-(methylsulfonyloxymethyl)-3-nitro-phenyl]methyl methanesulfonate Openeye Name: [4-(methylsulfonyloxymethyl)-3-nitro-phenyl]methyl methanesulfonate CAS Name: methanesulfonic acid [4-(methylsulfonyloxymethyl)-3-nitrophenyl]methyl ester IUPAC Name: [4-(methylsulfonyloxymethyl)-3-nitrophenyl]methyl methanesulfonate Traditional Name: methanesulfonic acid [4-(methylsulfonyloxymethyl)-3-nitro-benzyl] ester Formula: C10H13NO8S2 MolecularWeight: 339.34212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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