2-[2-(2-methoxy-2-oxidanylidene-ethyl)sulfanylethoxy]benzoic acid

Systemtic Name: 2-[2-(2-methoxy-2-oxidanylidene-ethyl)sulfanylethoxy]benzoic acid Openeye Name: 2-[2-(2-methoxy-2-oxo-ethyl)sulfanylethoxy]benzoic acid CAS Name: 2-[2-[(2-methoxy-2-oxoethyl)thio]ethoxy]benzoic acid IUPAC Name: 2-[2-(2-methoxy-2-oxoethyl)sulfanylethoxy]benzoic acid Traditional Name: 2-[2-[(2-keto-2-methoxy-ethyl)thio]ethoxy]benzoic acid Formula: C12H14O5S MolecularWeight: 270.30156

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCCOC1=CC=CC=C1C(=O)O

Isomeric SMILES

COC(=O)CSCCOC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C12H14O5S/c1-16-11(13)8-18-7-6-17-10-5-3-2-4-9(10)12(14)15/h2-5H,6-8H2,1H3,(H,14,15)