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

Systemtic Name: (4-iodophenyl)-[5-(4-methoxyphenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: [5-hydroxy-5-(4-methoxyphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone CAS Name: [5-hydroxy-5-(4-methoxyphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone IUPAC Name: [5-hydroxy-5-(4-methoxyphenyl)-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-iodophenyl)methanone Traditional Name: [5-hydroxy-5-(4-methoxyphenyl)-3-(trifluoromethyl)-2-pyrazolin-1-yl]-(4-iodophenyl)methanone Formula: C18H14F3IN2O3 MolecularWeight: 490.21504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC(=NN2C(=O)C3=CC=C(C=C3)I)C(F)(F)F)O

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC(=NN2C(=O)C3=CC=C(C=C3)I)C(F)(F)F)O

InChI

InChI=1S/C18H14F3IN2O3/c1-27-14-8-4-12(5-9-14)17(26)10-15(18(19,20)21)23-24(17)16(25)11-2-6-13(22)7-3-11/h2-9,26H,10H2,1H3