3-[3-[1-(3-cyclopentyl-2-phenylmethoxy-phenoxy)-2-methyl-1-oxidanylidene-propan-2-yl]sulfanyl-2-oxidanyl-propyl]sulfanylpropanoic acid

Systemtic Name: 3-[3-[1-(3-cyclopentyl-2-phenylmethoxy-phenoxy)-2-methyl-1-oxidanylidene-propan-2-yl]sulfanyl-2-oxidanyl-propyl]sulfanylpropanoic acid Openeye Name: 3-[3-[2-(2-benzyloxy-3-cyclopentyl-phenoxy)-1,1-dimethyl-2-oxo-ethyl]sulfanyl-2-hydroxy-propyl]sulfanylpropanoic acid CAS Name: 3-[[3-[[1-(3-cyclopentyl-2-phenylmethoxyphenoxy)-2-methyl-1-oxopropan-2-yl]thio]-2-hydroxypropyl]thio]propanoic acid IUPAC Name: 3-[3-[1-(3-cyclopentyl-2-phenylmethoxyphenoxy)-2-methyl-1-oxopropan-2-yl]sulfanyl-2-hydroxypropyl]sulfanylpropanoic acid Traditional Name: 3-[[3-[[2-(2-benzoxy-3-cyclopentyl-phenoxy)-2-keto-1,1-dimethyl-ethyl]thio]-2-hydroxy-propyl]thio]propionic acid Formula: C28H36O6S2 MolecularWeight: 532.71184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC1=CC=CC(=C1OCC2=CC=CC=C2)C3CCCC3)SCC(CSCCC(=O)O)O

Isomeric SMILES

CC(C)(C(=O)OC1=CC=CC(=C1OCC2=CC=CC=C2)C3CCCC3)SCC(CSCCC(=O)O)O

InChI

InChI=1S/C28H36O6S2/c1-28(2,36-19-22(29)18-35-16-15-25(30)31)27(32)34-24-14-8-13-23(21-11-6-7-12-21)26(24)33-17-20-9-4-3-5-10-20/h3-5,8-10,13-14,21-22,29H,6-7,11-12,15-19H2,1-2H3,(H,30,31)