3-[2-(3-methoxyphenyl)sulfanylethoxy]benzoic acid

Systemtic Name: 3-[2-(3-methoxyphenyl)sulfanylethoxy]benzoic acid Openeye Name: 3-[2-(3-methoxyphenyl)sulfanylethoxy]benzoic acid CAS Name: 3-[2-[(3-methoxyphenyl)thio]ethoxy]benzoic acid IUPAC Name: 3-[2-(3-methoxyphenyl)sulfanylethoxy]benzoic acid Traditional Name: 3-[2-[(3-methoxyphenyl)thio]ethoxy]benzoic acid Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SCCOC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

COC1=CC(=CC=C1)SCCOC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C16H16O4S/c1-19-13-5-3-7-15(11-13)21-9-8-20-14-6-2-4-12(10-14)16(17)18/h2-7,10-11H,8-9H2,1H3,(H,17,18)