[3-(3-bromophenyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-phenyl-methanone

Systemtic Name: [3-(3-bromophenyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-phenyl-methanone Openeye Name: [3-(3-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-phenyl-methanone CAS Name: [3-(3-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-phenylmethanone IUPAC Name: [3-(3-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-phenylmethanone Traditional Name: [3-(3-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-phenyl-methanone Formula: C17H12BrF3N2O2 MolecularWeight: 413.18859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1(C(F)(F)F)O)C(=O)C2=CC=CC=C2)C3=CC(=CC=C3)Br

Isomeric SMILES

C1C(=NN(C1(C(F)(F)F)O)C(=O)C2=CC=CC=C2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H12BrF3N2O2/c18-13-8-4-7-12(9-13)14-10-16(25,17(19,20)21)23(22-14)15(24)11-5-2-1-3-6-11/h1-9,25H,10H2