N-[1-(2-bromanyl-5-fluoranyl-phenoxy)-2-cyano-propan-2-yl]-4-(trifluoromethyloxy)benzamide

Systemtic Name: N-[1-(2-bromanyl-5-fluoranyl-phenoxy)-2-cyano-propan-2-yl]-4-(trifluoromethyloxy)benzamide Openeye Name: N-[2-(2-bromo-5-fluoro-phenoxy)-1-cyano-1-methyl-ethyl]-4-(trifluoromethoxy)benzamide CAS Name: N-[1-(2-bromo-5-fluorophenoxy)-2-cyanopropan-2-yl]-4-(trifluoromethoxy)benzamide IUPAC Name: N-[1-(2-bromo-5-fluorophenoxy)-2-cyanopropan-2-yl]-4-(trifluoromethoxy)benzamide Traditional Name: N-[2-(2-bromo-5-fluoro-phenoxy)-1-cyano-1-methyl-ethyl]-4-(trifluoromethoxy)benzamide Formula: C18H13BrF4N2O3 MolecularWeight: 461.205033

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=CC(=C1)F)Br)(C#N)NC(=O)C2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CC(COC1=C(C=CC(=C1)F)Br)(C#N)NC(=O)C2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C18H13BrF4N2O3/c1-17(9-24,10-27-15-8-12(20)4-7-14(15)19)25-16(26)11-2-5-13(6-3-11)28-18(21,22)23/h2-8H,10H2,1H3,(H,25,26)