(3,5-dinitro-4-oxidanyl-phenyl) methanesulfonate

Systemtic Name: (3,5-dinitro-4-oxidanyl-phenyl) methanesulfonate Openeye Name: (4-hydroxy-3,5-dinitro-phenyl) methanesulfonate CAS Name: methanesulfonic acid (4-hydroxy-3,5-dinitrophenyl) ester IUPAC Name: (4-hydroxy-3,5-dinitrophenyl) methanesulfonate Traditional Name: methanesulfonic acid (4-hydroxy-3,5-dinitro-phenyl) ester Formula: C7H6N2O8S MolecularWeight: 278.19614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)OC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C7H6N2O8S/c1-18(15,16)17-4-2-5(8(11)12)7(10)6(3-4)9(13)14/h2-3,10H,1H3