N2,N7-bis(2,5-dimethylphenyl)-9-hydroxyimino-4,5-dinitro-fluorene-2,7-disulfonamide

Systemtic Name: N2,N7-bis(2,5-dimethylphenyl)-9-hydroxyimino-4,5-dinitro-fluorene-2,7-disulfonamide Openeye Name: N2,N7-bis(2,5-dimethylphenyl)-9-hydroxyimino-4,5-dinitro-fluorene-2,7-disulfonamide CAS Name: N2,N7-bis(2,5-dimethylphenyl)-9-hydroxyimino-4,5-dinitrofluorene-2,7-disulfonamide IUPAC Name: 2-N,7-N-bis(2,5-dimethylphenyl)-9-hydroxyimino-4,5-dinitrofluorene-2,7-disulfonamide Traditional Name: N,N'-bis(2,5-dimethylphenyl)-9-hydroximino-4,5-dinitro-fluorene-2,7-disulfonamide Formula: C29H25N5O9S2 MolecularWeight: 651.6669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NS(=O)(=O)C2=CC(=C3C(=C2)C(=NO)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)NC5=C(C=CC(=C5)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NS(=O)(=O)C2=CC(=C3C(=C2)C(=NO)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)NC5=C(C=CC(=C5)C)C)[N+](=O)[O-]

InChI

InChI=1S/C29H25N5O9S2/c1-15-5-7-17(3)23(9-15)31-44(40,41)19-11-21-27(25(13-19)33(36)37)28-22(29(21)30-35)12-20(14-26(28)34(38)39)45(42,43)32-24-10-16(2)6-8-18(24)4/h5-14,31-32,35H,1-4H3