3-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-(2-tert-butoxy-2-oxo-ethyl)sulfanylpropanoic acid CAS Name: 3-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[(2-tert-butoxy-2-keto-ethyl)thio]propionic acid Formula: C9H16O4S MolecularWeight: 220.28594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O4S/c1-9(2,3)13-8(12)6-14-5-4-7(10)11/h4-6H2,1-3H3,(H,10,11)