9-hydroxyimino-N2,N2,N7,N7-tetrakis(3-methylbutyl)-4,5-dinitro-fluorene-2,7-disulfonamide

Systemtic Name: 9-hydroxyimino-N2,N2,N7,N7-tetrakis(3-methylbutyl)-4,5-dinitro-fluorene-2,7-disulfonamide Openeye Name: 9-hydroxyimino-N2,N2,N7,N7-tetraisopentyl-4,5-dinitro-fluorene-2,7-disulfonamide CAS Name: 9-hydroxyimino-N2,N2,N7,N7-tetrakis(3-methylbutyl)-4,5-dinitrofluorene-2,7-disulfonamide IUPAC Name: 9-hydroxyimino-2-N,2-N,7-N,7-N-tetrakis(3-methylbutyl)-4,5-dinitrofluorene-2,7-disulfonamide Traditional Name: 9-hydroximino-N,N,N',N'-tetraisoamyl-4,5-dinitro-fluorene-2,7-disulfonamide Formula: C33H49N5O9S2 MolecularWeight: 723.90026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCC(C)C)S(=O)(=O)C1=CC(=C2C(=C1)C(=NO)C3=CC(=CC(=C32)[N+](=O)[O-])S(=O)(=O)N(CCC(C)C)CCC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCN(CCC(C)C)S(=O)(=O)C1=CC(=C2C(=C1)C(=NO)C3=CC(=CC(=C32)[N+](=O)[O-])S(=O)(=O)N(CCC(C)C)CCC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C33H49N5O9S2/c1-21(2)9-13-35(14-10-22(3)4)48(44,45)25-17-27-31(29(19-25)37(40)41)32-28(33(27)34-39)18-26(20-30(32)38(42)43)49(46,47)36(15-11-23(5)6)16-12-24(7)8/h17-24,39H,9-16H2,1-8H3