ditetratriacontan-17-yl 2-oxidanylbutanedioate

Systemtic Name: ditetratriacontan-17-yl 2-oxidanylbutanedioate Openeye Name: bis(1-hexadecyloctadecyl) 2-hydroxybutanedioate CAS Name: 2-hydroxybutanedioic acid ditetratriacontan-17-yl ester IUPAC Name: ditetratriacontan-17-yl 2-hydroxybutanedioate Traditional Name: 2-hydroxysuccinic acid bis(1-cetyloctadecyl) ester Formula: C72H142O5 MolecularWeight: 1087.89488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)OC(=O)CC(C(=O)OC(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)OC(=O)CC(C(=O)OC(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC)O

InChI

InChI=1S/C72H142O5/c1-5-9-13-17-21-25-29-33-37-41-44-48-52-56-60-64-68(63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)76-71(74)67-70(73)72(75)77-69(65-61-57-53-49-45-40-36-32-28-24-20-16-12-8-4)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2/h68-70,73H,5-67H2,1-4H3