(5S)-3-(4-bromophenyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazole-1-carbaldehyde

Systemtic Name: (5S)-3-(4-bromophenyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazole-1-carbaldehyde Openeye Name: (5S)-3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazole-1-carbaldehyde CAS Name: (5S)-3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazole-1-carboxaldehyde IUPAC Name: (5S)-3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazole-1-carbaldehyde Traditional Name: (5S)-3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-2-pyrazoline-1-carbaldehyde Formula: C11H8BrF3N2O2 MolecularWeight: 337.09263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C(=NN([C@]1(C(F)(F)F)O)C=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C11H8BrF3N2O2/c12-8-3-1-7(2-4-8)9-5-10(19,11(13,14)15)17(6-18)16-9/h1-4,6,19H,5H2/t10-/m0/s1