2-[4-chloranyl-2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-chloranyl-2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]phenoxy]ethanoic acid Openeye Name: 2-[4-chloro-2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]phenoxy]acetic acid CAS Name: 2-[4-chloro-2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]phenoxy]acetic acid IUPAC Name: 2-[4-chloro-2-[4-methylsulfonyl-3-(trifluoromethyl)phenyl]phenoxy]acetic acid Traditional Name: 2-[4-chloro-2-[4-mesyl-3-(trifluoromethyl)phenyl]phenoxy]acetic acid Formula: C16H12ClF3O5S MolecularWeight: 408.77669

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C2=C(C=CC(=C2)Cl)OCC(=O)O)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C2=C(C=CC(=C2)Cl)OCC(=O)O)C(F)(F)F

InChI

InChI=1S/C16H12ClF3O5S/c1-26(23,24)14-5-2-9(6-12(14)16(18,19)20)11-7-10(17)3-4-13(11)25-8-15(21)22/h2-7H,8H2,1H3,(H,21,22)