4-((S)-5-(3,5-Dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4,5-dihydroisoxazol-3-yl)-N-((R)-2-(ethyl-d5)-3-oxoisoxazolidin-4-yl)-2-methylbenzamide

Analyte Name

4-((S)-5-(3,5-Dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4,5-dihydroisoxazol-3-yl)-N-((R)-2-(ethyl-d5)-3-oxoisoxazolidin-4-yl)-2-methylbenzamide

Molecular Formula

C23 D5 H14 Cl2 F4 N3 O4

Molecular Weight

553.345

Accurate Mass

552.1

SMILES

[2H]C([2H])([2H])C([2H])([2H])N1OC[C@@H](NC(=O)c2ccc(cc2C)C3=NO[C@@](C3)(c4cc(Cl)c(F)c(Cl)c4)C(F)(F)F)C1=O

InChI

InChI=1S/C23H19Cl2F4N3O4/c1-3-32-21(34)18(10-35-32)30-20(33)14-5-4-12(6-11(14)2)17-9-22(36-31-17,23(27,28)29)13-7-15(24)19(26)16(25)8-13/h4-8,18H,3,9-10H2,1-2H3,(H,30,33)/t18-,22+/m1/s1/i1D3,3D2

IUPAC

4-[(5S)-5-(3,5-dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]-2-methyl-N-[(4R)-3-oxo-2-(1,1,2,2,2-pentadeuterioethyl)-1,2-oxazolidin-4-yl]benzamide

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat