1-[5-(4-bromophenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[5-(4-bromophenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenyl-ethanone Openeye Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenyl-ethanone CAS Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenylethanone IUPAC Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-2-phenylethanone Traditional Name: 1-[5-(4-bromophenyl)-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-2-phenyl-ethanone Formula: C18H14BrF3N2O2 MolecularWeight: 427.21517

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1(C2=CC=C(C=C2)Br)O)C(=O)CC3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

C1C(=NN(C1(C2=CC=C(C=C2)Br)O)C(=O)CC3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H14BrF3N2O2/c19-14-8-6-13(7-9-14)17(26)11-15(18(20,21)22)23-24(17)16(25)10-12-4-2-1-3-5-12/h1-9,26H,10-11H2