4-[1,3-di(hexadecanoyloxy)propan-2-yloxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1,3-di(hexadecanoyloxy)propan-2-yloxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-hexadecanoyloxy-1-(hexadecanoyloxymethyl)ethoxy]-4-oxo-butanoic acid CAS Name: 4-[1,3-bis(1-oxohexadecoxy)propan-2-yloxy]-4-oxobutanoic acid IUPAC Name: 4-[1,3-di(hexadecanoyloxy)propan-2-yloxy]-4-oxobutanoic acid Traditional Name: 4-[2-hexadecanoyloxy-1-(hexadecanoyloxymethyl)ethoxy]-4-keto-butyric acid Formula: C39H72O8 MolecularWeight: 668.98418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCC(=O)O

InChI

InChI=1S/C39H72O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(42)45-33-35(47-39(44)32-31-36(40)41)34-46-38(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35H,3-34H2,1-2H3,(H,40,41)