N2,N7-dicyclohexyl-9-(dicyanomethylidene)-4,5-dinitro-fluorene-2,7-disulfonamide

Systemtic Name: N2,N7-dicyclohexyl-9-(dicyanomethylidene)-4,5-dinitro-fluorene-2,7-disulfonamide Openeye Name: N2,N7-dicyclohexyl-9-(dicyanomethylene)-4,5-dinitro-fluorene-2,7-disulfonamide CAS Name: N2,N7-dicyclohexyl-9-(dicyanomethylidene)-4,5-dinitrofluorene-2,7-disulfonamide IUPAC Name: 2-N,7-N-dicyclohexyl-9-(dicyanomethylidene)-4,5-dinitrofluorene-2,7-disulfonamide Traditional Name: N,N'-dicyclohexyl-9-(dicyanomethylene)-4,5-dinitro-fluorene-2,7-disulfonamide Formula: C28H28N6O8S2 MolecularWeight: 640.68732

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NS(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)NC5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NS(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)NC5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C28H28N6O8S2/c29-15-17(16-30)26-22-11-20(43(39,40)31-18-7-3-1-4-8-18)13-24(33(35)36)27(22)28-23(26)12-21(14-25(28)34(37)38)44(41,42)32-19-9-5-2-6-10-19/h11-14,18-19,31-32H,1-10H2