3-[3-[3-(3-cyclopentyl-2-phenylmethoxy-phenoxy)-2,2-dimethyl-3-oxidanylidene-propyl]sulfanyl-2-oxidanyl-propyl]sulfanylpropanoic acid

Systemtic Name: 3-[3-[3-(3-cyclopentyl-2-phenylmethoxy-phenoxy)-2,2-dimethyl-3-oxidanylidene-propyl]sulfanyl-2-oxidanyl-propyl]sulfanylpropanoic acid Openeye Name: 3-[3-[3-(2-benzyloxy-3-cyclopentyl-phenoxy)-2,2-dimethyl-3-oxo-propyl]sulfanyl-2-hydroxy-propyl]sulfanylpropanoic acid CAS Name: 3-[[3-[[3-(3-cyclopentyl-2-phenylmethoxyphenoxy)-2,2-dimethyl-3-oxopropyl]thio]-2-hydroxypropyl]thio]propanoic acid IUPAC Name: 3-[3-[3-(3-cyclopentyl-2-phenylmethoxyphenoxy)-2,2-dimethyl-3-oxopropyl]sulfanyl-2-hydroxypropyl]sulfanylpropanoic acid Traditional Name: 3-[[3-[[3-(2-benzoxy-3-cyclopentyl-phenoxy)-3-keto-2,2-dimethyl-propyl]thio]-2-hydroxy-propyl]thio]propionic acid Formula: C29H38O6S2 MolecularWeight: 546.73842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H38O6S2/c1-29(2,20-37-19-23(30)18-36-16-15-26(31)32)28(33)35-25-14-8-13-24(22-11-6-7-12-22)27(25)34-17-21-9-4-3-5-10-21/h3-5,8-10,13-14,22-23,30H,6-7,11-12,15-20H2,1-2H3,(H,31,32)