2-[7-[2-chloranyl-4-(trifluoromethyl)phenoxy]naphthalen-2-yl]oxysulfanylpropanoic acid

Systemtic Name: 2-[7-[2-chloranyl-4-(trifluoromethyl)phenoxy]naphthalen-2-yl]oxysulfanylpropanoic acid Openeye Name: 2-[[7-[2-chloro-4-(trifluoromethyl)phenoxy]-2-naphthyl]oxysulfanyl]propanoic acid CAS Name: 2-[[7-[2-chloro-4-(trifluoromethyl)phenoxy]-2-naphthalenyl]oxythio]propanoic acid IUPAC Name: 2-[7-[2-chloro-4-(trifluoromethyl)phenoxy]naphthalen-2-yl]oxysulfanylpropanoic acid Traditional Name: 2-[[7-[2-chloro-4-(trifluoromethyl)phenoxy]-2-naphthoxy]thio]propionic acid Formula: C20H14ClF3O4S MolecularWeight: 442.83597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SOC1=CC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)C=C1

Isomeric SMILES

CC(C(=O)O)SOC1=CC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)C=C1

InChI

InChI=1S/C20H14ClF3O4S/c1-11(19(25)26)29-28-16-6-3-12-2-5-15(8-13(12)9-16)27-18-7-4-14(10-17(18)21)20(22,23)24/h2-11H,1H3,(H,25,26)