7-(3,3-dimethylbutan-2-yloxy)-4,6-dinitro-2-(trifluoromethyl)-1H-benzimidazole

Systemtic Name: 7-(3,3-dimethylbutan-2-yloxy)-4,6-dinitro-2-(trifluoromethyl)-1H-benzimidazole Openeye Name: 4,6-dinitro-2-(trifluoromethyl)-7-(1,2,2-trimethylpropoxy)-1H-benzimidazole CAS Name: 7-(3,3-dimethylbutan-2-yloxy)-4,6-dinitro-2-(trifluoromethyl)-1H-benzimidazole IUPAC Name: 7-(3,3-dimethylbutan-2-yloxy)-4,6-dinitro-2-(trifluoromethyl)-1H-benzimidazole Traditional Name: 4,6-dinitro-2-(trifluoromethyl)-7-(1,2,2-trimethylpropoxy)-1H-benzimidazole Formula: C14H15F3N4O5 MolecularWeight: 376.28791

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)OC1=C(C=C(C2=C1NC(=N2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C(C)(C)C)OC1=C(C=C(C2=C1NC(=N2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H15F3N4O5/c1-6(13(2,3)4)26-11-8(21(24)25)5-7(20(22)23)9-10(11)19-12(18-9)14(15,16)17/h5-6H,1-4H3,(H,18,19)