propan-2-yl (3S)-4,4,4-tris(fluoranyl)-3-oxidanyl-3-phenyl-butanoate

Systemtic Name: propan-2-yl (3S)-4,4,4-tris(fluoranyl)-3-oxidanyl-3-phenyl-butanoate Openeye Name: isopropyl (3S)-4,4,4-trifluoro-3-hydroxy-3-phenyl-butanoate CAS Name: (3S)-4,4,4-trifluoro-3-hydroxy-3-phenylbutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3S)-4,4,4-trifluoro-3-hydroxy-3-phenylbutanoate Traditional Name: (3S)-4,4,4-trifluoro-3-hydroxy-3-phenyl-butyric acid isopropyl ester Formula: C13H15F3O3 MolecularWeight: 276.25161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)(C(F)(F)F)O

Isomeric SMILES

CC(C)OC(=O)C[C@](C1=CC=CC=C1)(C(F)(F)F)O

InChI

InChI=1S/C13H15F3O3/c1-9(2)19-11(17)8-12(18,13(14,15)16)10-6-4-3-5-7-10/h3-7,9,18H,8H2,1-2H3/t12-/m0/s1