N2,N7-dibutyl-9-hydroxyimino-4,5-dinitro-fluorene-2,7-disulfonamide

Systemtic Name: N2,N7-dibutyl-9-hydroxyimino-4,5-dinitro-fluorene-2,7-disulfonamide Openeye Name: N2,N7-dibutyl-9-hydroxyimino-4,5-dinitro-fluorene-2,7-disulfonamide CAS Name: N2,N7-dibutyl-9-hydroxyimino-4,5-dinitrofluorene-2,7-disulfonamide IUPAC Name: 2-N,7-N-dibutyl-9-hydroxyimino-4,5-dinitrofluorene-2,7-disulfonamide Traditional Name: N,N'-dibutyl-9-hydroximino-4,5-dinitro-fluorene-2,7-disulfonamide Formula: C21H25N5O9S2 MolecularWeight: 555.5813

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O9S2/c1-3-5-7-22-36(32,33)13-9-15-19(17(11-13)25(28)29)20-16(21(15)24-27)10-14(12-18(20)26(30)31)37(34,35)23-8-6-4-2/h9-12,22-23,27H,3-8H2,1-2H3