4-[2-(2-methylphenyl)sulfanylethoxy]benzoic acid

Systemtic Name: 4-[2-(2-methylphenyl)sulfanylethoxy]benzoic acid Openeye Name: 4-[2-(o-tolylsulfanyl)ethoxy]benzoic acid CAS Name: 4-[2-[(2-methylphenyl)thio]ethoxy]benzoic acid IUPAC Name: 4-[2-(2-methylphenyl)sulfanylethoxy]benzoic acid Traditional Name: 4-[2-(o-tolylthio)ethoxy]benzoic acid Formula: C16H16O3S MolecularWeight: 288.36144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCCOC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1SCCOC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H16O3S/c1-12-4-2-3-5-15(12)20-11-10-19-14-8-6-13(7-9-14)16(17)18/h2-9H,10-11H2,1H3,(H,17,18)