ethyl 2-[3-(2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-yl)propylsulfanyl]ethanoate

Systemtic Name: ethyl 2-[3-(2-oxidanyl-5-oxidanylidene-cyclopent-3-en-1-yl)propylsulfanyl]ethanoate Openeye Name: ethyl 2-[3-(2-hydroxy-5-oxo-cyclopent-3-en-1-yl)propylsulfanyl]acetate CAS Name: 2-[3-(2-hydroxy-5-oxo-1-cyclopent-3-enyl)propylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(2-hydroxy-5-oxocyclopent-3-en-1-yl)propylsulfanyl]acetate Traditional Name: 2-[3-(2-hydroxy-5-keto-cyclopent-3-en-1-yl)propylthio]acetic acid ethyl ester Formula: C12H18O4S MolecularWeight: 258.33392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCCCC1C(C=CC1=O)O

Isomeric SMILES

CCOC(=O)CSCCCC1C(C=CC1=O)O

InChI

InChI=1S/C12H18O4S/c1-2-16-12(15)8-17-7-3-4-9-10(13)5-6-11(9)14/h5-6,9-10,13H,2-4,7-8H2,1H3