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

Systemtic Name: 2-(3,4-diethoxyphenyl)-1-[5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Openeye Name: 2-(3,4-diethoxyphenyl)-1-[5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone CAS Name: 2-(3,4-diethoxyphenyl)-1-[5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone IUPAC Name: 2-(3,4-diethoxyphenyl)-1-[5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Traditional Name: 2-(3,4-diethoxyphenyl)-1-[5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]ethanone Formula: C16H19F3N2O4 MolecularWeight: 360.32827

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(=O)N2C(CC=N2)(C(F)(F)F)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC(=O)N2C(CC=N2)(C(F)(F)F)O)OCC

InChI

InChI=1S/C16H19F3N2O4/c1-3-24-12-6-5-11(9-13(12)25-4-2)10-14(22)21-15(23,7-8-20-21)16(17,18)19/h5-6,8-9,23H,3-4,7,10H2,1-2H3