tritridecyl benzene-1,2,4-tricarboxylate

Systemtic Name: tritridecyl benzene-1,2,4-tricarboxylate Openeye Name: tritridecyl benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid tritridecyl ester IUPAC Name: tritridecyl benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid tritridecyl ester Formula: C48H84O6 MolecularWeight: 757.17696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCCCCCCC)C(=O)OCCCCCCCCCCCCC

InChI

InChI=1S/C48H84O6/c1-4-7-10-13-16-19-22-25-28-31-34-39-52-46(49)43-37-38-44(47(50)53-40-35-32-29-26-23-20-17-14-11-8-5-2)45(42-43)48(51)54-41-36-33-30-27-24-21-18-15-12-9-6-3/h37-38,42H,4-36,39-41H2,1-3H3