2,6-bis(iodanyl)benzene-1,4-dicarbonitrile hydrate

Systemtic Name: 2,6-bis(iodanyl)benzene-1,4-dicarbonitrile hydrate Openeye Name: 2,6-diiodoterephthalonitrile hydrate CAS Name: 2,6-diiodobenzene-1,4-dicarbonitrile hydrate IUPAC Name: 2,6-diiodobenzene-1,4-dicarbonitrile hydrate Traditional Name: 2,6-diiodoterephthalonitrile hydrate Formula: C8H4I2N2O MolecularWeight: 397.9391

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1I)C#N)I)C#N.O

Isomeric SMILES

C1=C(C=C(C(=C1I)C#N)I)C#N.O

InChI

InChI=1S/C8H2I2N2.H2O/c9-7-1-5(3-11)2-8(10)6(7)4-12;/h1-2H;1H2