9-(dicyanomethylidene)-N2,N7-bis(3-methylphenyl)-4,5-dinitro-fluorene-2,7-disulfonamide

Systemtic Name: 9-(dicyanomethylidene)-N2,N7-bis(3-methylphenyl)-4,5-dinitro-fluorene-2,7-disulfonamide Openeye Name: 9-(dicyanomethylene)-N2,N7-bis(m-tolyl)-4,5-dinitro-fluorene-2,7-disulfonamide CAS Name: 9-(dicyanomethylidene)-N2,N7-bis(3-methylphenyl)-4,5-dinitrofluorene-2,7-disulfonamide IUPAC Name: 9-(dicyanomethylidene)-2-N,7-N-bis(3-methylphenyl)-4,5-dinitrofluorene-2,7-disulfonamide Traditional Name: 9-(dicyanomethylene)-N,N'-bis(m-tolyl)-4,5-dinitro-fluorene-2,7-disulfonamide Formula: C30H20N6O8S2 MolecularWeight: 656.6452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)NC5=CC=CC(=C5)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)NC5=CC=CC(=C5)C)[N+](=O)[O-]

InChI

InChI=1S/C30H20N6O8S2/c1-17-5-3-7-20(9-17)33-45(41,42)22-11-24-28(19(15-31)16-32)25-12-23(46(43,44)34-21-8-4-6-18(2)10-21)14-27(36(39)40)30(25)29(24)26(13-22)35(37)38/h3-14,33-34H,1-2H3