(2S)-2-[2-(3-cyanophenyl)-4-(trifluoromethyl)phenoxy]propanoic acid

Systemtic Name: (2S)-2-[2-(3-cyanophenyl)-4-(trifluoromethyl)phenoxy]propanoic acid Openeye Name: (2S)-2-[2-(3-cyanophenyl)-4-(trifluoromethyl)phenoxy]propanoic acid CAS Name: (2S)-2-[2-(3-cyanophenyl)-4-(trifluoromethyl)phenoxy]propanoic acid IUPAC Name: (2S)-2-[2-(3-cyanophenyl)-4-(trifluoromethyl)phenoxy]propanoic acid Traditional Name: (2S)-2-[2-(3-cyanophenyl)-4-(trifluoromethyl)phenoxy]propionic acid Formula: C17H12F3NO3 MolecularWeight: 335.27729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=C(C=C(C=C1)C(F)(F)F)C2=CC=CC(=C2)C#N

Isomeric SMILES

C[C@@H](C(=O)O)OC1=C(C=C(C=C1)C(F)(F)F)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H12F3NO3/c1-10(16(22)23)24-15-6-5-13(17(18,19)20)8-14(15)12-4-2-3-11(7-12)9-21/h2-8,10H,1H3,(H,22,23)/t10-/m0/s1