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

Systemtic Name: 2-(3,4-dimethylphenoxy)-1-[(5R)-3-ethyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Openeye Name: 2-(3,4-dimethylphenoxy)-1-[(5R)-3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone CAS Name: 2-(3,4-dimethylphenoxy)-1-[(5R)-3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone IUPAC Name: 2-(3,4-dimethylphenoxy)-1-[(5R)-3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Traditional Name: 2-(3,4-dimethylphenoxy)-1-[(5R)-3-ethyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]ethanone Formula: C16H19F3N2O3 MolecularWeight: 344.32887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)COC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCC1=NN([C@@](C1)(C(F)(F)F)O)C(=O)COC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C16H19F3N2O3/c1-4-12-8-15(23,16(17,18)19)21(20-12)14(22)9-24-13-6-5-10(2)11(3)7-13/h5-7,23H,4,8-9H2,1-3H3/t15-/m1/s1