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

Systemtic Name: (4-chloranyl-3,5-dinitro-phenyl) methanesulfonate Openeye Name: (4-chloro-3,5-dinitro-phenyl) methanesulfonate CAS Name: methanesulfonic acid (4-chloro-3,5-dinitrophenyl) ester IUPAC Name: (4-chloro-3,5-dinitrophenyl) methanesulfonate Traditional Name: methanesulfonic acid (4-chloro-3,5-dinitro-phenyl) ester Formula: C7H5ClN2O7S MolecularWeight: 296.6418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H5ClN2O7S/c1-18(15,16)17-4-2-5(9(11)12)7(8)6(3-4)10(13)14/h2-3H,1H3