5-(dioxidanylmethyl)-2-(4-nitrophenyl)-4-[4-(trifluoromethyl)phenyl]-1H-imidazole

Systemtic Name: 5-(dioxidanylmethyl)-2-(4-nitrophenyl)-4-[4-(trifluoromethyl)phenyl]-1H-imidazole Openeye Name: 5-(hydroperoxymethyl)-2-(4-nitrophenyl)-4-[4-(trifluoromethyl)phenyl]-1H-imidazole CAS Name: 5-(hydroperoxymethyl)-2-(4-nitrophenyl)-4-[4-(trifluoromethyl)phenyl]-1H-imidazole IUPAC Name: 5-(hydroperoxymethyl)-2-(4-nitrophenyl)-4-[4-(trifluoromethyl)phenyl]-1H-imidazole Traditional Name: 5-(hydroperoxymethyl)-2-(4-nitrophenyl)-4-[4-(trifluoromethyl)phenyl]-1H-imidazole Formula: C17H12F3N3O4 MolecularWeight: 379.29009

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])COO)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=C(NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])COO)C(F)(F)F

InChI

InChI=1S/C17H12F3N3O4/c18-17(19,20)12-5-1-10(2-6-12)15-14(9-27-26)21-16(22-15)11-3-7-13(8-4-11)23(24)25/h1-8,26H,9H2,(H,21,22)