2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[3-(4-iodanylphenoxy)-5-nitro-phenyl]ethanamide

Systemtic Name: 2-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[3-(4-iodanylphenoxy)-5-nitro-phenyl]ethanamide Openeye Name: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[3-(4-iodophenoxy)-5-nitro-phenyl]acetamide CAS Name: 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-[3-(4-iodophenoxy)-5-nitrophenyl]acetamide IUPAC Name: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[3-(4-iodophenoxy)-5-nitrophenyl]acetamide Traditional Name: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[3-(4-iodophenoxy)-5-nitro-phenyl]acetamide Formula: C19H13BrF3IN4O4 MolecularWeight: 625.1346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)I)[N+](=O)[O-])C(F)(F)F)Br

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)OC3=CC=C(C=C3)I)[N+](=O)[O-])C(F)(F)F)Br

InChI

InChI=1S/C19H13BrF3IN4O4/c1-10-17(20)18(19(21,22)23)26-27(10)9-16(29)25-12-6-13(28(30)31)8-15(7-12)32-14-4-2-11(24)3-5-14/h2-8H,9H2,1H3,(H,25,29)