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

Systemtic Name: 2-[2,7-bis(butylsulfanyl)-4,5-dinitro-fluoren-9-ylidene]propanedinitrile Openeye Name: 2-[2,7-bis(butylsulfanyl)-4,5-dinitro-fluoren-9-ylidene]propanedinitrile CAS Name: 2-[2,7-bis(butylthio)-4,5-dinitro-9-fluorenylidene]propanedinitrile IUPAC Name: 2-[2,7-bis(butylsulfanyl)-4,5-dinitrofluoren-9-ylidene]propanedinitrile Traditional Name: 2-[2,7-bis(butylthio)-4,5-dinitro-fluoren-9-ylidene]malononitrile Formula: C24H22N4O4S2 MolecularWeight: 494.58588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC(=C2C(=C1)C(=C(C#N)C#N)C3=CC(=CC(=C32)[N+](=O)[O-])SCCCC)[N+](=O)[O-]

Isomeric SMILES

CCCCSC1=CC(=C2C(=C1)C(=C(C#N)C#N)C3=CC(=CC(=C32)[N+](=O)[O-])SCCCC)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O4S2/c1-3-5-7-33-16-9-18-22(15(13-25)14-26)19-10-17(34-8-6-4-2)12-21(28(31)32)24(19)23(18)20(11-16)27(29)30/h9-12H,3-8H2,1-2H3