(E)-6-(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)sulfanylhex-2-enoic acid

Systemtic Name: (E)-6-(3-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)sulfanylhex-2-enoic acid Openeye Name: (E)-6-(3-hydroxy-5-oxo-cyclopenten-1-yl)sulfanylhex-2-enoic acid CAS Name: (E)-6-[(3-hydroxy-5-oxo-1-cyclopentenyl)thio]-2-hexenoic acid IUPAC Name: (E)-6-(3-hydroxy-5-oxocyclopenten-1-yl)sulfanylhex-2-enoic acid Traditional Name: (E)-6-[(3-hydroxy-5-keto-cyclopenten-1-yl)thio]hex-2-enoic acid Formula: C11H14O4S MolecularWeight: 242.29146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C=C(C1=O)SCCCC=CC(=O)O)O

Isomeric SMILES

C1C(C=C(C1=O)SCCC/C=C/C(=O)O)O

InChI

InChI=1S/C11H14O4S/c12-8-6-9(13)10(7-8)16-5-3-1-2-4-11(14)15/h2,4,7-8,12H,1,3,5-6H2,(H,14,15)/b4-2+