2-[4-[3-oxidanyl-5-oxidanylidene-2-(2-oxidanyl-3-phenoxy-propoxy)cyclopentyl]butylsulfinyl]ethanoic acid

Systemtic Name: 2-[4-[3-oxidanyl-5-oxidanylidene-2-(2-oxidanyl-3-phenoxy-propoxy)cyclopentyl]butylsulfinyl]ethanoic acid Openeye Name: 2-[4-[3-hydroxy-2-(2-hydroxy-3-phenoxy-propoxy)-5-oxo-cyclopentyl]butylsulfinyl]acetic acid CAS Name: 2-[4-[3-hydroxy-2-(2-hydroxy-3-phenoxypropoxy)-5-oxocyclopentyl]butylsulfinyl]acetic acid IUPAC Name: 2-[4-[3-hydroxy-2-(2-hydroxy-3-phenoxypropoxy)-5-oxocyclopentyl]butylsulfinyl]acetic acid Traditional Name: 2-[4-[3-hydroxy-2-(2-hydroxy-3-phenoxy-propoxy)-5-keto-cyclopentyl]butylsulfinyl]acetic acid Formula: C20H28O8S MolecularWeight: 428.49652

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C1=O)CCCCS(=O)CC(=O)O)OCC(COC2=CC=CC=C2)O)O

Isomeric SMILES

C1C(C(C(C1=O)CCCCS(=O)CC(=O)O)OCC(COC2=CC=CC=C2)O)O

InChI

InChI=1S/C20H28O8S/c21-14(11-27-15-6-2-1-3-7-15)12-28-20-16(17(22)10-18(20)23)8-4-5-9-29(26)13-19(24)25/h1-3,6-7,14,16,18,20-21,23H,4-5,8-13H2,(H,24,25)