4-tert-butyl-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazole

Systemtic Name: 4-tert-butyl-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazole Openeye Name: 4-tert-butyl-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazole CAS Name: 4-tert-butyl-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazole IUPAC Name: 4-tert-butyl-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazole Traditional Name: 4-tert-butyl-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazole Formula: C12H11F3N4O4 MolecularWeight: 332.23535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC(=N2)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=C2C(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NC(=N2)C(F)(F)F

InChI

InChI=1S/C12H11F3N4O4/c1-11(2,3)7-5(18(20)21)4-6(19(22)23)8-9(7)17-10(16-8)12(13,14)15/h4H,1-3H3,(H,16,17)