octan-2-yl 3-(3-octan-2-yloxy-3-oxidanylidene-propyl)sulfanylpropanoate

Systemtic Name: octan-2-yl 3-(3-octan-2-yloxy-3-oxidanylidene-propyl)sulfanylpropanoate Openeye Name: 1-methylheptyl 3-[3-(1-methylheptoxy)-3-oxo-propyl]sulfanylpropanoate CAS Name: 3-[(3-octan-2-yloxy-3-oxopropyl)thio]propanoic acid octan-2-yl ester IUPAC Name: octan-2-yl 3-(3-octan-2-yloxy-3-oxopropyl)sulfanylpropanoate Traditional Name: 3-[[3-keto-3-(1-methylheptoxy)propyl]thio]propionic acid 1-methylheptyl ester Formula: C22H42O4S MolecularWeight: 402.63148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)CCSCCC(=O)OC(C)CCCCCC

Isomeric SMILES

CCCCCCC(C)OC(=O)CCSCCC(=O)OC(C)CCCCCC

InChI

InChI=1S/C22H42O4S/c1-5-7-9-11-13-19(3)25-21(23)15-17-27-18-16-22(24)26-20(4)14-12-10-8-6-2/h19-20H,5-18H2,1-4H3