N2,N7-bis(2-methyl-1-oxidanyl-propan-2-yl)-4,5-dinitro-9-oxidanylidene-fluorene-2,7-disulfonamide

Systemtic Name: N2,N7-bis(2-methyl-1-oxidanyl-propan-2-yl)-4,5-dinitro-9-oxidanylidene-fluorene-2,7-disulfonamide Openeye Name: N2,N7-bis(2-hydroxy-1,1-dimethyl-ethyl)-4,5-dinitro-9-oxo-fluorene-2,7-disulfonamide CAS Name: N2,N7-bis(1-hydroxy-2-methylpropan-2-yl)-4,5-dinitro-9-oxofluorene-2,7-disulfonamide IUPAC Name: 2-N,7-N-bis(1-hydroxy-2-methylpropan-2-yl)-4,5-dinitro-9-oxofluorene-2,7-disulfonamide Traditional Name: N,N'-bis(2-hydroxy-1,1-dimethyl-ethyl)-9-keto-4,5-dinitro-fluorene-2,7-disulfonamide Formula: C21H24N4O11S2 MolecularWeight: 572.56546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O11S2/c1-20(2,9-26)22-37(33,34)11-5-13-17(15(7-11)24(29)30)18-14(19(13)28)6-12(8-16(18)25(31)32)38(35,36)23-21(3,4)10-27/h5-8,22-23,26-27H,9-10H2,1-4H3