2-[2-(methylsulfonyloxymethyl)-5-nitro-phenyl]ethyl methanesulfonate

Systemtic Name: 2-[2-(methylsulfonyloxymethyl)-5-nitro-phenyl]ethyl methanesulfonate Openeye Name: 2-[2-(methylsulfonyloxymethyl)-5-nitro-phenyl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[2-(methylsulfonyloxymethyl)-5-nitrophenyl]ethyl ester IUPAC Name: 2-[2-(methylsulfonyloxymethyl)-5-nitrophenyl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[2-(methylsulfonyloxymethyl)-5-nitro-phenyl]ethyl ester Formula: C11H15NO8S2 MolecularWeight: 353.3687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC1=C(C=CC(=C1)[N+](=O)[O-])COS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OCCC1=C(C=CC(=C1)[N+](=O)[O-])COS(=O)(=O)C

InChI

InChI=1S/C11H15NO8S2/c1-21(15,16)19-6-5-9-7-11(12(13)14)4-3-10(9)8-20-22(2,17)18/h3-4,7H,5-6,8H2,1-2H3