7-(diethylsulfamoyl)-4,5-dinitro-9-oxidanylidene-fluorene-2-sulfonic acid

Systemtic Name: 7-(diethylsulfamoyl)-4,5-dinitro-9-oxidanylidene-fluorene-2-sulfonic acid Openeye Name: 7-(diethylsulfamoyl)-4,5-dinitro-9-oxo-fluorene-2-sulfonic acid CAS Name: 7-(diethylsulfamoyl)-4,5-dinitro-9-oxo-2-fluorenesulfonic acid IUPAC Name: 7-(diethylsulfamoyl)-4,5-dinitro-9-oxofluorene-2-sulfonic acid Traditional Name: 7-(diethylsulfamoyl)-9-keto-4,5-dinitro-fluorene-2-sulfonic acid Formula: C17H15N3O10S2 MolecularWeight: 485.4451

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C32)[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C32)[N+](=O)[O-])S(=O)(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O10S2/c1-3-18(4-2)31(26,27)9-5-11-15(13(7-9)19(22)23)16-12(17(11)21)6-10(32(28,29)30)8-14(16)20(24)25/h5-8H,3-4H2,1-2H3,(H,28,29,30)