6-[3-nitro-4,5-bis(oxidanyl)phenyl]-5-oxidanyl-1H-pyrazine-2,2-dicarbonitrile

Systemtic Name: 6-[3-nitro-4,5-bis(oxidanyl)phenyl]-5-oxidanyl-1H-pyrazine-2,2-dicarbonitrile Openeye Name: 6-(3,4-dihydroxy-5-nitro-phenyl)-5-hydroxy-1H-pyrazine-2,2-dicarbonitrile CAS Name: 6-(3,4-dihydroxy-5-nitrophenyl)-5-hydroxy-1H-pyrazine-2,2-dicarbonitrile IUPAC Name: 6-(3,4-dihydroxy-5-nitrophenyl)-5-hydroxy-1H-pyrazine-2,2-dicarbonitrile Traditional Name: 6-(3,4-dihydroxy-5-nitro-phenyl)-5-hydroxy-1H-pyrazine-2,2-dicarbonitrile Formula: C12H7N5O5 MolecularWeight: 301.21448

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1[N+](=O)[O-])O)O)C2=C(N=CC(N2)(C#N)C#N)O

Isomeric SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])O)O)C2=C(N=CC(N2)(C#N)C#N)O

InChI

InChI=1S/C12H7N5O5/c13-3-12(4-14)5-15-11(20)9(16-12)6-1-7(17(21)22)10(19)8(18)2-6/h1-2,5,16,18-20H