6-(trifluoromethyl)-1H-benzimidazole; 2,4,6-trinitrophenol

Systemtic Name: 6-(trifluoromethyl)-1H-benzimidazole; 2,4,6-trinitrophenol Openeye Name: picric acid; 6-(trifluoromethyl)-1H-benzimidazole CAS Name: 6-(trifluoromethyl)-1H-benzimidazole; 2,4,6-trinitrophenol IUPAC Name: 6-(trifluoromethyl)-1H-benzimidazole; 2,4,6-trinitrophenol Traditional Name: picric acid; 6-(trifluoromethyl)-1H-benzimidazole Formula: C14H8F3N5O7 MolecularWeight: 415.23783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)NC=N2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)NC=N2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H5F3N2.C6H3N3O7/c9-8(10,11)5-1-2-6-7(3-5)13-4-12-6;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-4H,(H,12,13);1-2,10H