4,5-bis(chloranyl)-3,6-dinitro-benzene-1,2-dicarbonitrile

Systemtic Name: 4,5-bis(chloranyl)-3,6-dinitro-benzene-1,2-dicarbonitrile Openeye Name: 4,5-dichloro-3,6-dinitro-phthalonitrile CAS Name: 4,5-dichloro-3,6-dinitrobenzene-1,2-dicarbonitrile IUPAC Name: 4,5-dichloro-3,6-dinitrobenzene-1,2-dicarbonitrile Traditional Name: 4,5-dichloro-3,6-dinitro-phthalonitrile Formula: C8Cl2N4O4 MolecularWeight: 287.016

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Descriptors Computed from Structure

Canonical SMILES:

C(#N)C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C(#N)C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C8Cl2N4O4/c9-5-6(10)8(14(17)18)4(2-12)3(1-11)7(5)13(15)16