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

Systemtic Name: tris[(E)-hexadec-4-enyl] benzene-1,2,4-tricarboxylate Openeye Name: tris[(E)-hexadec-4-enyl] benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid tris[(E)-hexadec-4-enyl] ester IUPAC Name: tris[(E)-hexadec-4-enyl] benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid tris[(E)-hexadec-4-enyl] ester Formula: C57H96O6 MolecularWeight: 877.36854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C57H96O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-48-61-55(58)52-46-47-53(56(59)62-49-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)54(51-52)57(60)63-50-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h34-39,46-47,51H,4-33,40-45,48-50H2,1-3H3/b37-34+,38-35+,39-36+