2-[2-[[2-(carboxymethyloxy)-5-chloranyl-phenyl]methyl]-4-methylsulfonyl-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[[2-(carboxymethyloxy)-5-chloranyl-phenyl]methyl]-4-methylsulfonyl-phenoxy]ethanoic acid Openeye Name: 2-[2-[[2-(carboxymethyloxy)-5-chloro-phenyl]methyl]-4-methylsulfonyl-phenoxy]acetic acid CAS Name: 2-[2-[[2-(carboxymethyloxy)-5-chlorophenyl]methyl]-4-methylsulfonylphenoxy]acetic acid IUPAC Name: 2-[2-[[2-(carboxymethyloxy)-5-chlorophenyl]methyl]-4-methylsulfonylphenoxy]acetic acid Traditional Name: 2-[2-[2-(carboxymethyloxy)-5-chloro-benzyl]-4-mesyl-phenoxy]acetic acid Formula: C18H17ClO8S MolecularWeight: 428.84078

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)O)CC2=C(C=CC(=C2)Cl)OCC(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OCC(=O)O)CC2=C(C=CC(=C2)Cl)OCC(=O)O

InChI

InChI=1S/C18H17ClO8S/c1-28(24,25)14-3-5-16(27-10-18(22)23)12(8-14)6-11-7-13(19)2-4-15(11)26-9-17(20)21/h2-5,7-8H,6,9-10H2,1H3,(H,20,21)(H,22,23)