2-[3-[2,2-dimethyl-3-oxidanylidene-3-(2-phenylmethoxyphenoxy)propyl]sulfanyl-3-oxidanyl-propyl]sulfanylethanoic acid

Systemtic Name: 2-[3-[2,2-dimethyl-3-oxidanylidene-3-(2-phenylmethoxyphenoxy)propyl]sulfanyl-3-oxidanyl-propyl]sulfanylethanoic acid Openeye Name: 2-[3-[3-(2-benzyloxyphenoxy)-2,2-dimethyl-3-oxo-propyl]sulfanyl-3-hydroxy-propyl]sulfanylacetic acid CAS Name: 2-[[3-[[2,2-dimethyl-3-oxo-3-(2-phenylmethoxyphenoxy)propyl]thio]-3-hydroxypropyl]thio]acetic acid IUPAC Name: 2-[3-[2,2-dimethyl-3-oxo-3-(2-phenylmethoxyphenoxy)propyl]sulfanyl-3-hydroxypropyl]sulfanylacetic acid Traditional Name: 2-[[3-[[3-(2-benzoxyphenoxy)-3-keto-2,2-dimethyl-propyl]thio]-3-hydroxy-propyl]thio]acetic acid Formula: C23H28O6S2 MolecularWeight: 464.59482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CSC(CCSCC(=O)O)O)C(=O)OC1=CC=CC=C1OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(CSC(CCSCC(=O)O)O)C(=O)OC1=CC=CC=C1OCC2=CC=CC=C2

InChI

InChI=1S/C23H28O6S2/c1-23(2,16-31-21(26)12-13-30-15-20(24)25)22(27)29-19-11-7-6-10-18(19)28-14-17-8-4-3-5-9-17/h3-11,21,26H,12-16H2,1-2H3,(H,24,25)