trioctadecyl benzene-1,2,4-tricarboxylate

Systemtic Name: trioctadecyl benzene-1,2,4-tricarboxylate Openeye Name: trioctadecyl benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid trioctadecyl ester IUPAC Name: trioctadecyl benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid tristearyl ester Formula: C63H114O6 MolecularWeight: 967.57566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C63H114O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-54-67-61(64)58-52-53-59(62(65)68-55-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)60(57-58)63(66)69-56-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h52-53,57H,4-51,54-56H2,1-3H3