2-(3,4-dimethylphenoxy)-1-[(5S)-5-oxidanyl-3-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone

Systemtic Name: 2-(3,4-dimethylphenoxy)-1-[(5S)-5-oxidanyl-3-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Openeye Name: 2-(3,4-dimethylphenoxy)-1-[(5S)-5-hydroxy-3-(4-pyridyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone CAS Name: 2-(3,4-dimethylphenoxy)-1-[(5S)-5-hydroxy-3-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone IUPAC Name: 2-(3,4-dimethylphenoxy)-1-[(5S)-5-hydroxy-3-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Traditional Name: 2-(3,4-dimethylphenoxy)-1-[(5S)-5-hydroxy-3-(4-pyridyl)-5-(trifluoromethyl)-2-pyrazolin-1-yl]ethanone Formula: C19H18F3N3O3 MolecularWeight: 393.35973

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)N2C(CC(=N2)C3=CC=NC=C3)(C(F)(F)F)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)N2[C@](CC(=N2)C3=CC=NC=C3)(C(F)(F)F)O)C

InChI

InChI=1S/C19H18F3N3O3/c1-12-3-4-15(9-13(12)2)28-11-17(26)25-18(27,19(20,21)22)10-16(24-25)14-5-7-23-8-6-14/h3-9,27H,10-11H2,1-2H3/t18-/m0/s1