2-(4-nitroimidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(4-nitroimidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(4-nitroimidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-(4-nitro-1-imidazolyl)-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(4-nitroimidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(4-nitroimidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C12H9F3N4O3 MolecularWeight: 314.22007

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CN2C=C(N=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CN2C=C(N=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C12H9F3N4O3/c13-12(14,15)8-2-1-3-9(4-8)17-11(20)6-18-5-10(16-7-18)19(21)22/h1-5,7H,6H2,(H,17,20)