N-[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]-4-(trifluoromethyloxy)benzamide

Systemtic Name: N-[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]-4-(trifluoromethyloxy)benzamide Openeye Name: N-[3-(4-bromo-1-methyl-pyrazol-3-yl)phenyl]-4-(trifluoromethoxy)benzamide CAS Name: N-[3-(4-bromo-1-methyl-3-pyrazolyl)phenyl]-4-(trifluoromethoxy)benzamide IUPAC Name: N-[3-(4-bromo-1-methylpyrazol-3-yl)phenyl]-4-(trifluoromethoxy)benzamide Traditional Name: N-[3-(4-bromo-1-methyl-pyrazol-3-yl)phenyl]-4-(trifluoromethoxy)benzamide Formula: C18H13BrF3N3O2 MolecularWeight: 440.21393

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)OC(F)(F)F)Br

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)OC(F)(F)F)Br

InChI

InChI=1S/C18H13BrF3N3O2/c1-25-10-15(19)16(24-25)12-3-2-4-13(9-12)23-17(26)11-5-7-14(8-6-11)27-18(20,21)22/h2-10H,1H3,(H,23,26)