N-(2,2-dimethylpropyl)-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazol-4-amine

Systemtic Name: N-(2,2-dimethylpropyl)-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazol-4-amine Openeye Name: N-(2,2-dimethylpropyl)-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazol-4-amine CAS Name: N-(2,2-dimethylpropyl)-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazol-4-amine IUPAC Name: N-(2,2-dimethylpropyl)-5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazol-4-amine Traditional Name: [5,7-dinitro-2-(trifluoromethyl)-1H-benzimidazol-4-yl]-neopentyl-amine Formula: C13H14F3N5O4 MolecularWeight: 361.27657

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=C(C=C(C2=C1N=C(N2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CNC1=C(C=C(C2=C1N=C(N2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14F3N5O4/c1-12(2,3)5-17-8-6(20(22)23)4-7(21(24)25)9-10(8)19-11(18-9)13(14,15)16/h4,17H,5H2,1-3H3,(H,18,19)