2,6-dinitro-4-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 2,6-dinitro-4-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2,6-dinitro-4-(trifluoromethyl)benzonitrile CAS Name: 2,6-dinitro-4-(trifluoromethyl)benzonitrile IUPAC Name: 2,6-dinitro-4-(trifluoromethyl)benzonitrile Traditional Name: 2,6-dinitro-4-(trifluoromethyl)benzonitrile Formula: C8H2F3N3O4 MolecularWeight: 261.11439

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H2F3N3O4/c9-8(10,11)4-1-6(13(15)16)5(3-12)7(2-4)14(17)18/h1-2H