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

Systemtic Name: (4-iodophenyl)-[5-oxidanyl-5-phenyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: [5-hydroxy-5-phenyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone CAS Name: [5-hydroxy-5-phenyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone IUPAC Name: [5-hydroxy-5-phenyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone Traditional Name: [5-hydroxy-5-phenyl-3-(trifluoromethyl)-2-pyrazolin-1-yl]-(4-iodophenyl)methanone Formula: C17H12F3IN2O2 MolecularWeight: 460.18906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12F3IN2O2/c18-17(19,20)14-10-16(25,12-4-2-1-3-5-12)23(22-14)15(24)11-6-8-13(21)9-7-11/h1-9,25H,10H2