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

Systemtic Name: (2S)-2-[4-chloranyl-2-(2-chloranyl-4-methylsulfonyl-phenyl)sulfanyl-phenoxy]propanoic acid Openeye Name: (2S)-2-[4-chloro-2-(2-chloro-4-methylsulfonyl-phenyl)sulfanyl-phenoxy]propanoic acid CAS Name: (2S)-2-[4-chloro-2-[(2-chloro-4-methylsulfonylphenyl)thio]phenoxy]propanoic acid IUPAC Name: (2S)-2-[4-chloro-2-(2-chloro-4-methylsulfonylphenyl)sulfanylphenoxy]propanoic acid Traditional Name: (2S)-2-[4-chloro-2-[(2-chloro-4-mesyl-phenyl)thio]phenoxy]propionic acid Formula: C16H14Cl2O5S2 MolecularWeight: 421.31536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)O)OC1=C(C=C(C=C1)Cl)SC2=C(C=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C16H14Cl2O5S2/c1-9(16(19)20)23-13-5-3-10(17)7-15(13)24-14-6-4-11(8-12(14)18)25(2,21)22/h3-9H,1-2H3,(H,19,20)/t9-/m0/s1