9-(dicyanomethylidene)-N2,N7-bis(furan-2-ylmethyl)-4,5-dinitro-fluorene-2,7-disulfonamide

Systemtic Name: 9-(dicyanomethylidene)-N2,N7-bis(furan-2-ylmethyl)-4,5-dinitro-fluorene-2,7-disulfonamide Openeye Name: 9-(dicyanomethylene)-N2,N7-bis(2-furylmethyl)-4,5-dinitro-fluorene-2,7-disulfonamide CAS Name: 9-(dicyanomethylidene)-N2,N7-bis(2-furanylmethyl)-4,5-dinitrofluorene-2,7-disulfonamide IUPAC Name: 9-(dicyanomethylidene)-2-N,7-N-bis(furan-2-ylmethyl)-4,5-dinitrofluorene-2,7-disulfonamide Traditional Name: 9-(dicyanomethylene)-N,N'-bis(2-furfuryl)-4,5-dinitro-fluorene-2,7-disulfonamide Formula: C26H16N6O10S2 MolecularWeight: 636.56944

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNS(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)NCC5=CC=CO5)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CNS(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)NCC5=CC=CO5)[N+](=O)[O-]

InChI

InChI=1S/C26H16N6O10S2/c27-11-15(12-28)24-20-7-18(43(37,38)29-13-16-3-1-5-41-16)9-22(31(33)34)25(20)26-21(24)8-19(10-23(26)32(35)36)44(39,40)30-14-17-4-2-6-42-17/h1-10,29-30H,13-14H2