2-[3-methoxy-4-[2-[4-(2-methylbutan-2-yl)phenoxy]ethylsulfanyl]phenoxy]propanoic acid

Systemtic Name: 2-[3-methoxy-4-[2-[4-(2-methylbutan-2-yl)phenoxy]ethylsulfanyl]phenoxy]propanoic acid Openeye Name: 2-[4-[2-[4-(1,1-dimethylpropyl)phenoxy]ethylsulfanyl]-3-methoxy-phenoxy]propanoic acid CAS Name: 2-[3-methoxy-4-[2-[4-(2-methylbutan-2-yl)phenoxy]ethylthio]phenoxy]propanoic acid IUPAC Name: 2-[3-methoxy-4-[2-[4-(2-methylbutan-2-yl)phenoxy]ethylsulfanyl]phenoxy]propanoic acid Traditional Name: 2-[4-[2-(4-tert-amylphenoxy)ethylthio]-3-methoxy-phenoxy]propionic acid Formula: C23H30O5S MolecularWeight: 418.5463

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCCSC2=C(C=C(C=C2)OC(C)C(=O)O)OC

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCCSC2=C(C=C(C=C2)OC(C)C(=O)O)OC

InChI

InChI=1S/C23H30O5S/c1-6-23(3,4)17-7-9-18(10-8-17)27-13-14-29-21-12-11-19(15-20(21)26-5)28-16(2)22(24)25/h7-12,15-16H,6,13-14H2,1-5H3,(H,24,25)