bis(14-methylpentadecyl) (9E,28E)-19-undecylheptatriaconta-9,28-dienedioate

Systemtic Name: bis(14-methylpentadecyl) (9E,28E)-19-undecylheptatriaconta-9,28-dienedioate Openeye Name: bis(14-methylpentadecyl) (9E,28E)-19-undecylheptatriaconta-9,28-dienedioate CAS Name: (9E,28E)-19-undecylheptatriaconta-9,28-dienedioic acid bis(14-methylpentadecyl) ester IUPAC Name: bis(14-methylpentadecyl) (9E,28E)-19-undecylheptatriaconta-9,28-dienedioate Traditional Name: (9E,28E)-19-undecylheptatriaconta-9,28-dienedioic acid bis(14-methylpentadecyl) ester Formula: C80H154O4 MolecularWeight: 1180.07636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCCCCCCC=CCCCCCCCC(=O)OCCCCCCCCCCCCCC(C)C)CCCCCCCCC=CCCCCCCCC(=O)OCCCCCCCCCCCCCC(C)C

Isomeric SMILES

CCCCCCCCCCCC(CCCCCCCC/C=C/CCCCCCCC(=O)OCCCCCCCCCCCCCC(C)C)CCCCCCCC/C=C/CCCCCCCC(=O)OCCCCCCCCCCCCCC(C)C

InChI

InChI=1S/C80H154O4/c1-6-7-8-9-10-31-42-51-60-69-78(70-61-52-43-34-25-17-13-11-15-19-27-36-45-54-63-72-79(81)83-74-65-56-47-38-29-21-23-32-40-49-58-67-76(2)3)71-62-53-44-35-26-18-14-12-16-20-28-37-46-55-64-73-80(82)84-75-66-57-48-39-30-22-24-33-41-50-59-68-77(4)5/h11-12,15-16,76-78H,6-10,13-14,17-75H2,1-5H3/b15-11+,16-12+