13-[2,4-bis(chloranyl)phenoxy]-8-methylsulfonyl-12-oxidanyl-tridecanoic acid

Systemtic Name: 13-[2,4-bis(chloranyl)phenoxy]-8-methylsulfonyl-12-oxidanyl-tridecanoic acid Openeye Name: 13-(2,4-dichlorophenoxy)-12-hydroxy-8-methylsulfonyl-tridecanoic acid CAS Name: 13-(2,4-dichlorophenoxy)-12-hydroxy-8-methylsulfonyltridecanoic acid IUPAC Name: 13-(2,4-dichlorophenoxy)-12-hydroxy-8-methylsulfonyltridecanoic acid Traditional Name: 13-(2,4-dichlorophenoxy)-12-hydroxy-8-mesyl-tridecanoic acid Formula: C20H30Cl2O6S MolecularWeight: 469.4196

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(CCCCCCC(=O)O)CCCC(COC1=C(C=C(C=C1)Cl)Cl)O

Isomeric SMILES

CS(=O)(=O)C(CCCCCCC(=O)O)CCCC(COC1=C(C=C(C=C1)Cl)Cl)O

InChI

InChI=1S/C20H30Cl2O6S/c1-29(26,27)17(8-4-2-3-5-10-20(24)25)9-6-7-16(23)14-28-19-12-11-15(21)13-18(19)22/h11-13,16-17,23H,2-10,14H2,1H3,(H,24,25)