[3-hexadecanoyloxy-2-[(2-methyl-4-oxidanylidene-1,3-benzodioxin-2-yl)oxy]propyl] hexadecanoate

Systemtic Name: [3-hexadecanoyloxy-2-[(2-methyl-4-oxidanylidene-1,3-benzodioxin-2-yl)oxy]propyl] hexadecanoate Openeye Name: [3-hexadecanoyloxy-2-[(2-methyl-4-oxo-1,3-benzodioxin-2-yl)oxy]propyl] hexadecanoate CAS Name: hexadecanoic acid [2-[(2-methyl-4-oxo-1,3-benzodioxin-2-yl)oxy]-3-(1-oxohexadecoxy)propyl] ester IUPAC Name: [3-hexadecanoyloxy-2-[(2-methyl-4-oxo-1,3-benzodioxin-2-yl)oxy]propyl] hexadecanoate Traditional Name: palmitic acid [3-hexadecanoyloxy-2-[(4-keto-2-methyl-1,3-benzodioxin-2-yl)oxy]propyl] ester Formula: C44H74O8 MolecularWeight: 731.05356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC1(OC2=CC=CC=C2C(=O)O1)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC1(OC2=CC=CC=C2C(=O)O1)C

InChI

InChI=1S/C44H74O8/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-34-41(45)48-36-38(50-44(3)51-40-33-31-30-32-39(40)43(47)52-44)37-49-42(46)35-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h30-33,38H,4-29,34-37H2,1-3H3