2-[4-chloranyl-2-(2-chloranyl-4-methylsulfonyl-phenyl)sulfanyl-phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-chloranyl-2-(2-chloranyl-4-methylsulfonyl-phenyl)sulfanyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-chloro-2-(2-chloro-4-methylsulfonyl-phenyl)sulfanyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-chloro-2-[(2-chloro-4-methylsulfonylphenyl)thio]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-chloro-2-(2-chloro-4-methylsulfonylphenyl)sulfanylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-chloro-2-[(2-chloro-4-mesyl-phenyl)thio]phenoxy]-2-methyl-propionic acid Formula: C17H16Cl2O5S2 MolecularWeight: 435.34194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=C(C=C(C=C1)Cl)SC2=C(C=C(C=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC(C)(C(=O)O)OC1=C(C=C(C=C1)Cl)SC2=C(C=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C17H16Cl2O5S2/c1-17(2,16(20)21)24-13-6-4-10(18)8-15(13)25-14-7-5-11(9-12(14)19)26(3,22)23/h4-9H,1-3H3,(H,20,21)