[5-(4-ethylphenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [5-(4-ethylphenyl)-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-yl-methanone Openeye Name: [5-(4-ethylphenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(4-pyridyl)methanone CAS Name: [5-(4-ethylphenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-ylmethanone IUPAC Name: [5-(4-ethylphenyl)-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-pyridin-4-ylmethanone Traditional Name: [5-(4-ethylphenyl)-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-(4-pyridyl)methanone Formula: C18H16F3N3O2 MolecularWeight: 363.33375

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2(CC(=NN2C(=O)C3=CC=NC=C3)C(F)(F)F)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2(CC(=NN2C(=O)C3=CC=NC=C3)C(F)(F)F)O

InChI

InChI=1S/C18H16F3N3O2/c1-2-12-3-5-14(6-4-12)17(26)11-15(18(19,20)21)23-24(17)16(25)13-7-9-22-10-8-13/h3-10,26H,2,11H2,1H3