2-[1-(2-methyloctan-2-yloxy)-3-methylsulfanyl-propan-2-yl]oxyethanoic acid

Systemtic Name: 2-[1-(2-methyloctan-2-yloxy)-3-methylsulfanyl-propan-2-yl]oxyethanoic acid Openeye Name: 2-[1-(1,1-dimethylheptoxymethyl)-2-methylsulfanyl-ethoxy]acetic acid CAS Name: 2-[1-(2-methyloctan-2-yloxy)-3-(methylthio)propan-2-yl]oxyacetic acid IUPAC Name: 2-[1-(2-methyloctan-2-yloxy)-3-methylsulfanylpropan-2-yl]oxyacetic acid Traditional Name: 2-[1-(1,1-dimethylheptoxymethyl)-2-(methylthio)ethoxy]acetic acid Formula: C15H30O4S MolecularWeight: 306.4613

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)OCC(CSC)OCC(=O)O

Isomeric SMILES

CCCCCCC(C)(C)OCC(CSC)OCC(=O)O

InChI

InChI=1S/C15H30O4S/c1-5-6-7-8-9-15(2,3)19-10-13(12-20-4)18-11-14(16)17/h13H,5-12H2,1-4H3,(H,16,17)