methyl (2R,3R)-2-oxidanyl-5-oxidanylidene-3-thiophen-2-yl-hexanoate

Systemtic Name: methyl (2R,3R)-2-oxidanyl-5-oxidanylidene-3-thiophen-2-yl-hexanoate Openeye Name: methyl (2R,3R)-2-hydroxy-5-oxo-3-(2-thienyl)hexanoate CAS Name: (2R,3R)-2-hydroxy-5-oxo-3-thiophen-2-ylhexanoic acid methyl ester IUPAC Name: methyl (2R,3R)-2-hydroxy-5-oxo-3-thiophen-2-ylhexanoate Traditional Name: (2R,3R)-2-hydroxy-5-keto-3-(2-thienyl)hexanoic acid methyl ester Formula: C11H14O4S MolecularWeight: 242.29146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C1=CC=CS1)C(C(=O)OC)O

Isomeric SMILES

CC(=O)C[C@@H](C1=CC=CS1)[C@H](C(=O)OC)O

InChI

InChI=1S/C11H14O4S/c1-7(12)6-8(9-4-3-5-16-9)10(13)11(14)15-2/h3-5,8,10,13H,6H2,1-2H3/t8-,10+/m0/s1