2-[2-methyl-4-[2-(2-methyl-4-propan-2-yl-phenyl)ethylsulfanyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-methyl-4-[2-(2-methyl-4-propan-2-yl-phenyl)ethylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-(4-isopropyl-2-methyl-phenyl)ethylsulfanyl]-2-methyl-phenoxy]acetic acid CAS Name: 2-[2-methyl-4-[2-(2-methyl-4-propan-2-ylphenyl)ethylthio]phenoxy]acetic acid IUPAC Name: 2-[2-methyl-4-[2-(2-methyl-4-propan-2-ylphenyl)ethylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-(4-isopropyl-2-methyl-phenyl)ethylthio]-2-methyl-phenoxy]acetic acid Formula: C21H26O3S MolecularWeight: 358.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)C)CCSC2=CC(=C(C=C2)OCC(=O)O)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)C)CCSC2=CC(=C(C=C2)OCC(=O)O)C

InChI

InChI=1S/C21H26O3S/c1-14(2)18-6-5-17(15(3)11-18)9-10-25-19-7-8-20(16(4)12-19)24-13-21(22)23/h5-8,11-12,14H,9-10,13H2,1-4H3,(H,22,23)