2-[2,6-dimethyl-4-[(4-phenylphenyl)methylsulfanyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2,6-dimethyl-4-[(4-phenylphenyl)methylsulfanyl]phenoxy]ethanoic acid Openeye Name: 2-[2,6-dimethyl-4-[(4-phenylphenyl)methylsulfanyl]phenoxy]acetic acid CAS Name: 2-[2,6-dimethyl-4-[(4-phenylphenyl)methylthio]phenoxy]acetic acid IUPAC Name: 2-[2,6-dimethyl-4-[(4-phenylphenyl)methylsulfanyl]phenoxy]acetic acid Traditional Name: 2-[2,6-dimethyl-4-[(4-phenylbenzyl)thio]phenoxy]acetic acid Formula: C23H22O3S MolecularWeight: 378.48398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)O)C)SCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)O)C)SCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H22O3S/c1-16-12-21(13-17(2)23(16)26-14-22(24)25)27-15-18-8-10-20(11-9-18)19-6-4-3-5-7-19/h3-13H,14-15H2,1-2H3,(H,24,25)