diphenyl 9-(dicyanomethylidene)-4,5-dinitro-fluorene-2,7-disulfonate

Systemtic Name: diphenyl 9-(dicyanomethylidene)-4,5-dinitro-fluorene-2,7-disulfonate Openeye Name: diphenyl 9-(dicyanomethylene)-4,5-dinitro-fluorene-2,7-disulfonate CAS Name: 9-(dicyanomethylidene)-4,5-dinitrofluorene-2,7-disulfonic acid diphenyl ester IUPAC Name: diphenyl 9-(dicyanomethylidene)-4,5-dinitrofluorene-2,7-disulfonate Traditional Name: 9-(dicyanomethylene)-4,5-dinitro-fluorene-2,7-disulfonic acid diphenyl ester Formula: C28H14N4O10S2 MolecularWeight: 630.56156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)OC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)OC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H14N4O10S2/c29-15-17(16-30)26-22-11-20(43(37,38)41-18-7-3-1-4-8-18)13-24(31(33)34)27(22)28-23(26)12-21(14-25(28)32(35)36)44(39,40)42-19-9-5-2-6-10-19/h1-14H