5-nitro-2-(4-nitrophenyl)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(4-nitrophenyl)benzenecarbonitrile Openeye Name: 5-nitro-2-(4-nitrophenyl)benzonitrile CAS Name: 5-nitro-2-(4-nitrophenyl)benzonitrile IUPAC Name: 5-nitro-2-(4-nitrophenyl)benzonitrile Traditional Name: 5-nitro-2-(4-nitrophenyl)benzonitrile Formula: C13H7N3O4 MolecularWeight: 269.21238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=C(C=C2)[N+](=O)[O-])C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=C(C=C2)[N+](=O)[O-])C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H7N3O4/c14-8-10-7-12(16(19)20)5-6-13(10)9-1-3-11(4-2-9)15(17)18/h1-7H