2-[4-[(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)sulfanylmethyl]phenoxy]propanoic acid

Systemtic Name: 2-[4-[(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)sulfanylmethyl]phenoxy]propanoic acid Openeye Name: 2-[4-[(3-hydroxy-5-oxo-cyclopenten-1-yl)sulfanylmethyl]phenoxy]propanoic acid CAS Name: 2-[4-[[(3-hydroxy-5-oxo-1-cyclopentenyl)thio]methyl]phenoxy]propanoic acid IUPAC Name: 2-[4-[(3-hydroxy-5-oxocyclopenten-1-yl)sulfanylmethyl]phenoxy]propanoic acid Traditional Name: 2-[4-[[(3-hydroxy-5-keto-cyclopenten-1-yl)thio]methyl]phenoxy]propionic acid Formula: C15H16O5S MolecularWeight: 308.34954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=C(C=C1)CSC2=CC(CC2=O)O

Isomeric SMILES

CC(C(=O)O)OC1=CC=C(C=C1)CSC2=CC(CC2=O)O

InChI

InChI=1S/C15H16O5S/c1-9(15(18)19)20-12-4-2-10(3-5-12)8-21-14-7-11(16)6-13(14)17/h2-5,7,9,11,16H,6,8H2,1H3,(H,18,19)