1-[5-[4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenyl]ethanone

Systemtic Name: 1-[5-[4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenyl]ethanone Openeye Name: 1-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenyl]ethanone CAS Name: 1-[5-[[4-chloro-1-methyl-5-(trifluoromethyl)-3-pyrazolyl]oxy]-2-nitrophenyl]ethanone IUPAC Name: 1-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitrophenyl]ethanone Traditional Name: 1-[5-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-2-nitro-phenyl]ethanone Formula: C13H9ClF3N3O4 MolecularWeight: 363.67647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)OC2=NN(C(=C2Cl)C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)OC2=NN(C(=C2Cl)C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C13H9ClF3N3O4/c1-6(21)8-5-7(3-4-9(8)20(22)23)24-12-10(14)11(13(15,16)17)19(2)18-12/h3-5H,1-2H3