2-[4,5-dinitro-2,7-bis(piperidin-1-ylsulfonyl)fluoren-9-ylidene]propanedinitrile

Systemtic Name: 2-[4,5-dinitro-2,7-bis(piperidin-1-ylsulfonyl)fluoren-9-ylidene]propanedinitrile Openeye Name: 2-[4,5-dinitro-2,7-bis(1-piperidylsulfonyl)fluoren-9-ylidene]propanedinitrile CAS Name: 2-[4,5-dinitro-2,7-bis(1-piperidinylsulfonyl)-9-fluorenylidene]propanedinitrile IUPAC Name: 2-[4,5-dinitro-2,7-bis(piperidin-1-ylsulfonyl)fluoren-9-ylidene]propanedinitrile Traditional Name: 2-[4,5-dinitro-2,7-bis(piperidinosulfonyl)fluoren-9-ylidene]malononitrile Formula: C26H24N6O8S2 MolecularWeight: 612.63416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)N5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C3C(=C2)C(=C(C#N)C#N)C4=CC(=CC(=C43)[N+](=O)[O-])S(=O)(=O)N5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C26H24N6O8S2/c27-15-17(16-28)24-20-11-18(41(37,38)29-7-3-1-4-8-29)13-22(31(33)34)25(20)26-21(24)12-19(14-23(26)32(35)36)42(39,40)30-9-5-2-6-10-30/h11-14H,1-10H2