dihexadecyl 2-[[(E)-octadec-9-enoyl]oxymethyl]pentanedioate

Systemtic Name: dihexadecyl 2-[[(E)-octadec-9-enoyl]oxymethyl]pentanedioate Openeye Name: dihexadecyl 2-[[(E)-octadec-9-enoyl]oxymethyl]pentanedioate CAS Name: 2-[[(E)-1-oxooctadec-9-enoxy]methyl]pentanedioic acid dihexadecyl ester IUPAC Name: dihexadecyl 2-[[(E)-octadec-9-enoyl]oxymethyl]pentanedioate Traditional Name: 2-[[(E)-octadec-9-enoyl]oxymethyl]glutaric acid dicetyl ester Formula: C56H106O6 MolecularWeight: 875.43724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CCC(COC(=O)CCCCCCCC=CCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CCC(COC(=O)CCCCCCC/C=C/CCCCCCCC)C(=O)OCCCCCCCCCCCCCCCC

InChI

InChI=1S/C56H106O6/c1-4-7-10-13-16-19-22-25-28-29-32-35-38-41-44-47-54(57)62-52-53(56(59)61-51-46-43-40-37-34-31-27-24-21-18-15-12-9-6-3)48-49-55(58)60-50-45-42-39-36-33-30-26-23-20-17-14-11-8-5-2/h25,28,53H,4-24,26-27,29-52H2,1-3H3/b28-25+