2-[2,5-dimethyl-4-[(4-phenylmethoxyphenyl)methylsulfanyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2,5-dimethyl-4-[(4-phenylmethoxyphenyl)methylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(4-benzyloxyphenyl)methylsulfanyl]-2,5-dimethyl-phenoxy]acetic acid CAS Name: 2-[2,5-dimethyl-4-[(4-phenylmethoxyphenyl)methylthio]phenoxy]acetic acid IUPAC Name: 2-[2,5-dimethyl-4-[(4-phenylmethoxyphenyl)methylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[4-[(4-benzoxybenzyl)thio]-2,5-dimethyl-phenoxy]acetic acid Formula: C24H24O4S MolecularWeight: 408.50996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1SCC2=CC=C(C=C2)OCC3=CC=CC=C3)C)OCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1SCC2=CC=C(C=C2)OCC3=CC=CC=C3)C)OCC(=O)O

InChI

InChI=1S/C24H24O4S/c1-17-13-23(18(2)12-22(17)28-15-24(25)26)29-16-20-8-10-21(11-9-20)27-14-19-6-4-3-5-7-19/h3-13H,14-16H2,1-2H3,(H,25,26)