N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[[4-fluoranyl-2-(trifluoromethyl)phenyl]methyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[4-fluoro-2-(trifluoromethyl)benzyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C18H12F4N4O3 MolecularWeight: 408.306493

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCC2=C(C=C(C=C2)F)C(F)(F)F)[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCC2=C(C=C(C=C2)F)C(F)(F)F)[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C18H12F4N4O3/c19-13-3-1-12(14(8-13)18(20,21)22)9-24-17(27)11-2-4-15(16(7-11)26(28)29)25-6-5-23-10-25/h1-8,10H,9H2,(H,24,27)