5-[(1-methoxy-1-oxidanylidene-propan-2-yl)sulfanylmethyl]-4-oxidanylidene-cyclopent-2-ene-1-carboxylic acid

Systemtic Name: 5-[(1-methoxy-1-oxidanylidene-propan-2-yl)sulfanylmethyl]-4-oxidanylidene-cyclopent-2-ene-1-carboxylic acid Openeye Name: 5-[(2-methoxy-1-methyl-2-oxo-ethyl)sulfanylmethyl]-4-oxo-cyclopent-2-ene-1-carboxylic acid CAS Name: 5-[[(1-methoxy-1-oxopropan-2-yl)thio]methyl]-4-oxo-1-cyclopent-2-enecarboxylic acid IUPAC Name: 5-[(1-methoxy-1-oxopropan-2-yl)sulfanylmethyl]-4-oxocyclopent-2-ene-1-carboxylic acid Traditional Name: 4-keto-5-[[(2-keto-2-methoxy-1-methyl-ethyl)thio]methyl]cyclopent-2-ene-1-carboxylic acid Formula: C11H14O5S MolecularWeight: 258.29086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SCC1C(C=CC1=O)C(=O)O

Isomeric SMILES

CC(C(=O)OC)SCC1C(C=CC1=O)C(=O)O

InChI

InChI=1S/C11H14O5S/c1-6(11(15)16-2)17-5-8-7(10(13)14)3-4-9(8)12/h3-4,6-8H,5H2,1-2H3,(H,13,14)