4,5-dinitro-9-oxidanylidene-N2,N7-bis(1-phenylethyl)fluorene-2,7-disulfonamide

Systemtic Name: 4,5-dinitro-9-oxidanylidene-N2,N7-bis(1-phenylethyl)fluorene-2,7-disulfonamide Openeye Name: 4,5-dinitro-9-oxo-N2,N7-bis(1-phenylethyl)fluorene-2,7-disulfonamide CAS Name: 4,5-dinitro-9-oxo-N2,N7-bis(1-phenylethyl)fluorene-2,7-disulfonamide IUPAC Name: 4,5-dinitro-9-oxo-2-N,7-N-bis(1-phenylethyl)fluorene-2,7-disulfonamide Traditional Name: 9-keto-4,5-dinitro-N,N'-bis(1-phenylethyl)fluorene-2,7-disulfonamide Formula: C29H24N4O9S2 MolecularWeight: 636.65226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H24N4O9S2/c1-17(19-9-5-3-6-10-19)30-43(39,40)21-13-23-27(25(15-21)32(35)36)28-24(29(23)34)14-22(16-26(28)33(37)38)44(41,42)31-18(2)20-11-7-4-8-12-20/h3-18,30-31H,1-2H3