(3-hexadecanoyloxy-3-propan-2-yloxycarbonyloxy-oct-7-enyl) hexadecanoate

Systemtic Name: (3-hexadecanoyloxy-3-propan-2-yloxycarbonyloxy-oct-7-enyl) hexadecanoate Openeye Name: (3-hexadecanoyloxy-3-isopropoxycarbonyloxy-oct-7-enyl) hexadecanoate CAS Name: hexadecanoic acid [3-(1-oxohexadecoxy)-3-[oxo(propan-2-yloxy)methoxy]oct-7-enyl] ester IUPAC Name: (3-hexadecanoyloxy-3-propan-2-yloxycarbonyloxyoct-7-enyl) hexadecanoate Traditional Name: palmitic acid (3-hexadecanoyloxy-3-isopropoxycarbonyloxy-oct-7-enyl) ester Formula: C44H82O7 MolecularWeight: 723.11768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCCC(CCCC=C)(OC(=O)CCCCCCCCCCCCCCC)OC(=O)OC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCCC(CCCC=C)(OC(=O)CCCCCCCCCCCCCCC)OC(=O)OC(C)C

InChI

InChI=1S/C44H82O7/c1-6-9-12-14-16-18-20-22-24-26-28-30-32-35-41(45)48-39-38-44(37-34-11-8-3,51-43(47)49-40(4)5)50-42(46)36-33-31-29-27-25-23-21-19-17-15-13-10-7-2/h8,40H,3,6-7,9-39H2,1-2,4-5H3