[(2R,3R)-1,1,1-tris(fluoranyl)-3-oxidanyl-3-phenyl-propan-2-yl] benzoate

Systemtic Name: [(2R,3R)-1,1,1-tris(fluoranyl)-3-oxidanyl-3-phenyl-propan-2-yl] benzoate Openeye Name: [(1R)-2,2,2-trifluoro-1-[(R)-hydroxy(phenyl)methyl]ethyl] benzoate CAS Name: benzoic acid [(2R,3R)-1,1,1-trifluoro-3-hydroxy-3-phenylpropan-2-yl] ester IUPAC Name: [(2R,3R)-1,1,1-trifluoro-3-hydroxy-3-phenylpropan-2-yl] benzoate Traditional Name: benzoic acid [(1R)-2,2,2-trifluoro-1-[(R)-hydroxy(phenyl)methyl]ethyl] ester Formula: C16H13F3O3 MolecularWeight: 310.26783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(F)(F)F)OC(=O)C2=CC=CC=C2)O

Isomeric SMILES

C1=CC=C(C=C1)[C@H]([C@H](C(F)(F)F)OC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C16H13F3O3/c17-16(18,19)14(13(20)11-7-3-1-4-8-11)22-15(21)12-9-5-2-6-10-12/h1-10,13-14,20H/t13-,14-/m1/s1