2-[3-(dicyanomethylsulfonyl)-5-[diisocyano(sulfanylperoxy)methyl]phenyl]sulfonylpropanedinitrile

Systemtic Name: 2-[3-(dicyanomethylsulfonyl)-5-[diisocyano(sulfanylperoxy)methyl]phenyl]sulfonylpropanedinitrile Openeye Name: 2-[3-(dicyanomethylsulfonyl)-5-[diisocyano(sulfanylperoxy)methyl]phenyl]sulfonylpropanedinitrile CAS Name: 2-[3-(dicyanomethylsulfonyl)-5-[diisocyano(mercaptodioxy)methyl]phenyl]sulfonylpropanedinitrile IUPAC Name: 2-[3-(dicyanomethylsulfonyl)-5-[diisocyano(sulfanylperoxy)methyl]phenyl]sulfonylpropanedinitrile Traditional Name: 2-[3-(dicyanomethylsulfonyl)-5-[diisocyano(mercaptoperoxy)methyl]phenyl]sulfonylmalononitrile Formula: C15H6N6O6S3 MolecularWeight: 462.43974

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C(C1=CC(=CC(=C1)S(=O)(=O)C(C#N)C#N)S(=O)(=O)C(C#N)C#N)([N+]#[C-])OOS

Isomeric SMILES

[C-]#[N+]C(C1=CC(=CC(=C1)S(=O)(=O)C(C#N)C#N)S(=O)(=O)C(C#N)C#N)([N+]#[C-])OOS

InChI

InChI=1S/C15H6N6O6S3/c1-20-15(21-2,26-27-28)10-3-11(29(22,23)13(6-16)7-17)5-12(4-10)30(24,25)14(8-18)9-19/h3-5,13-14,28H