6-[2-(3-iodanyl-2-oxidanyl-phenyl)carbonyloxyethylsulfinyl]hexanoic acid

Systemtic Name: 6-[2-(3-iodanyl-2-oxidanyl-phenyl)carbonyloxyethylsulfinyl]hexanoic acid Openeye Name: 6-[2-(2-hydroxy-3-iodo-benzoyl)oxyethylsulfinyl]hexanoic acid CAS Name: 6-[2-[(2-hydroxy-3-iodophenyl)-oxomethoxy]ethylsulfinyl]hexanoic acid IUPAC Name: 6-[2-(2-hydroxy-3-iodobenzoyl)oxyethylsulfinyl]hexanoic acid Traditional Name: 6-[2-(2-hydroxy-3-iodo-benzoyl)oxyethylsulfinyl]hexanoic acid Formula: C15H19IO6S MolecularWeight: 454.27723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)I)O)C(=O)OCCS(=O)CCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)I)O)C(=O)OCCS(=O)CCCCCC(=O)O

InChI

InChI=1S/C15H19IO6S/c16-12-6-4-5-11(14(12)19)15(20)22-8-10-23(21)9-3-1-2-7-13(17)18/h4-6,19H,1-3,7-10H2,(H,17,18)