[3-(4-chloranyl-4-oxidanylidene-butanoyl)oxy-2-hexadecanoyloxy-propyl] hexadecanoate

Systemtic Name: [3-(4-chloranyl-4-oxidanylidene-butanoyl)oxy-2-hexadecanoyloxy-propyl] hexadecanoate Openeye Name: [3-(4-chloro-4-oxo-butanoyl)oxy-2-hexadecanoyloxy-propyl] hexadecanoate CAS Name: hexadecanoic acid [3-(4-chloro-1,4-dioxobutoxy)-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: [3-(4-chloro-4-oxobutanoyl)oxy-2-hexadecanoyloxypropyl] hexadecanoate Traditional Name: palmitic acid [3-(4-chloro-4-keto-butanoyl)oxy-2-hexadecanoyloxy-propyl] ester Formula: C39H71ClO7 MolecularWeight: 687.42984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C39H71ClO7/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(42)45-33-35(34-46-38(43)32-31-36(40)41)47-39(44)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35H,3-34H2,1-2H3