tris[(E)-octadec-4-enyl] benzene-1,2,4-tricarboxylate

Systemtic Name: tris[(E)-octadec-4-enyl] benzene-1,2,4-tricarboxylate Openeye Name: tris[(E)-octadec-4-enyl] benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid tris[(E)-octadec-4-enyl] ester IUPAC Name: tris[(E)-octadec-4-enyl] benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid tris[(E)-octadec-4-enyl] ester Formula: C63H108O6 MolecularWeight: 961.52802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCC=CCCCCCCCCCCCCC)C(=O)OCCCC=CCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC/C=C/CCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCC/C=C/CCCCCCCCCCCCC)C(=O)OCCC/C=C/CCCCCCCCCCCCC

InChI

InChI=1S/C63H108O6/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/h40-45,52-53,57H,4-39,46-51,54-56H2,1-3H3/b43-40+,44-41+,45-42+