2-[4-chloranyl-2-(4-ethylsulfonyl-2-methyl-phenyl)sulfanyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-chloranyl-2-(4-ethylsulfonyl-2-methyl-phenyl)sulfanyl-phenoxy]ethanoic acid Openeye Name: 2-[4-chloro-2-(4-ethylsulfonyl-2-methyl-phenyl)sulfanyl-phenoxy]acetic acid CAS Name: 2-[4-chloro-2-[(4-ethylsulfonyl-2-methylphenyl)thio]phenoxy]acetic acid IUPAC Name: 2-[4-chloro-2-(4-ethylsulfonyl-2-methylphenyl)sulfanylphenoxy]acetic acid Traditional Name: 2-[4-chloro-2-[(4-esyl-2-methyl-phenyl)thio]phenoxy]acetic acid Formula: C17H17ClO5S2 MolecularWeight: 400.89688

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)SC2=C(C=CC(=C2)Cl)OCC(=O)O)C

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)SC2=C(C=CC(=C2)Cl)OCC(=O)O)C

InChI

InChI=1S/C17H17ClO5S2/c1-3-25(21,22)13-5-7-15(11(2)8-13)24-16-9-12(18)4-6-14(16)23-10-17(19)20/h4-9H,3,10H2,1-2H3,(H,19,20)