3-(2-oxidanylidene-2-propan-2-yloxy-ethyl)sulfanylpropanoic acid

Systemtic Name: 3-(2-oxidanylidene-2-propan-2-yloxy-ethyl)sulfanylpropanoic acid Openeye Name: 3-(2-isopropoxy-2-oxo-ethyl)sulfanylpropanoic acid CAS Name: 3-[(2-oxo-2-propan-2-yloxyethyl)thio]propanoic acid IUPAC Name: 3-(2-oxo-2-propan-2-yloxyethyl)sulfanylpropanoic acid Traditional Name: 3-[(2-isopropoxy-2-keto-ethyl)thio]propionic acid Formula: C8H14O4S MolecularWeight: 206.25936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSCCC(=O)O

Isomeric SMILES

CC(C)OC(=O)CSCCC(=O)O

InChI

InChI=1S/C8H14O4S/c1-6(2)12-8(11)5-13-4-3-7(9)10/h6H,3-5H2,1-2H3,(H,9,10)