2-[4-[2-(4-tert-butylphenyl)ethylsulfanyl]-5-methoxy-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-(4-tert-butylphenyl)ethylsulfanyl]-5-methoxy-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[2-(4-tert-butylphenyl)ethylsulfanyl]-5-methoxy-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-[2-(4-tert-butylphenyl)ethylthio]-5-methoxy-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-[2-(4-tert-butylphenyl)ethylsulfanyl]-5-methoxy-2-methylphenoxy]acetic acid Traditional Name: 2-[4-[2-(4-tert-butylphenyl)ethylthio]-5-methoxy-2-methyl-phenoxy]acetic acid Formula: C22H28O4S MolecularWeight: 388.52032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OCC(=O)O)OC)SCCC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1OCC(=O)O)OC)SCCC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H28O4S/c1-15-12-20(19(25-5)13-18(15)26-14-21(23)24)27-11-10-16-6-8-17(9-7-16)22(2,3)4/h6-9,12-13H,10-11,14H2,1-5H3,(H,23,24)