2-(2-ethanoylsulfanylethyl)-6-(2-methoxy-2-oxidanylidene-ethyl)benzoic acid

Systemtic Name: 2-(2-ethanoylsulfanylethyl)-6-(2-methoxy-2-oxidanylidene-ethyl)benzoic acid Openeye Name: 2-(2-acetylsulfanylethyl)-6-(2-methoxy-2-oxo-ethyl)benzoic acid CAS Name: 2-[2-(acetylthio)ethyl]-6-(2-methoxy-2-oxoethyl)benzoic acid IUPAC Name: 2-(2-acetylsulfanylethyl)-6-(2-methoxy-2-oxoethyl)benzoic acid Traditional Name: 2-[2-(acetylthio)ethyl]-6-(2-keto-2-methoxy-ethyl)benzoic acid Formula: C14H16O5S MolecularWeight: 296.33884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC1=CC=CC(=C1C(=O)O)CC(=O)OC

Isomeric SMILES

CC(=O)SCCC1=CC=CC(=C1C(=O)O)CC(=O)OC

InChI

InChI=1S/C14H16O5S/c1-9(15)20-7-6-10-4-3-5-11(8-12(16)19-2)13(10)14(17)18/h3-5H,6-8H2,1-2H3,(H,17,18)