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

Systemtic Name: (4-bromophenyl)-[3-(4-methoxyphenyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: (4-bromophenyl)-[5-hydroxy-3-(4-methoxyphenyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: (4-bromophenyl)-[5-hydroxy-3-(4-methoxyphenyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (4-bromophenyl)-[5-hydroxy-3-(4-methoxyphenyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: (4-bromophenyl)-[5-hydroxy-3-(4-methoxyphenyl)-5-(trifluoromethyl)-2-pyrazolin-1-yl]methanone Formula: C18H14BrF3N2O3 MolecularWeight: 443.21457

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(C2)(C(F)(F)F)O)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(C2)(C(F)(F)F)O)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H14BrF3N2O3/c1-27-14-8-4-11(5-9-14)15-10-17(26,18(20,21)22)24(23-15)16(25)12-2-6-13(19)7-3-12/h2-9,26H,10H2,1H3