2-(3-methylphenyl)-2-(4-methylsulfanylphenoxy)ethanoic acid

Systemtic Name: 2-(3-methylphenyl)-2-(4-methylsulfanylphenoxy)ethanoic acid Openeye Name: 2-(4-methylsulfanylphenoxy)-2-(m-tolyl)acetic acid CAS Name: 2-(3-methylphenyl)-2-[4-(methylthio)phenoxy]acetic acid IUPAC Name: 2-(3-methylphenyl)-2-(4-methylsulfanylphenoxy)acetic acid Traditional Name: 2-[4-(methylthio)phenoxy]-2-(m-tolyl)acetic acid Formula: C16H16O3S MolecularWeight: 288.36144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C(=O)O)OC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=CC(=CC=C1)C(C(=O)O)OC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H16O3S/c1-11-4-3-5-12(10-11)15(16(17)18)19-13-6-8-14(20-2)9-7-13/h3-10,15H,1-2H3,(H,17,18)