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

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

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=CC(=C2)Cl)CC(=O)O)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=CC(=C2)Cl)CC(=O)O)C(F)(F)F

InChI

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