(2-oxidanylideneoxolan-3-yl) 2-methoxy-4-methylsulfanyl-benzoate

Systemtic Name: (2-oxidanylideneoxolan-3-yl) 2-methoxy-4-methylsulfanyl-benzoate Openeye Name: (2-oxotetrahydrofuran-3-yl) 2-methoxy-4-methylsulfanyl-benzoate CAS Name: 2-methoxy-4-(methylthio)benzoic acid (2-oxo-3-oxolanyl) ester IUPAC Name: (2-oxooxolan-3-yl) 2-methoxy-4-methylsulfanylbenzoate Traditional Name: 2-methoxy-4-(methylthio)benzoic acid (2-ketotetrahydrofuran-3-yl) ester Formula: C13H14O5S MolecularWeight: 282.31226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)OC2CCOC2=O

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)OC2CCOC2=O

InChI

InChI=1S/C13H14O5S/c1-16-11-7-8(19-2)3-4-9(11)12(14)18-10-5-6-17-13(10)15/h3-4,7,10H,5-6H2,1-2H3