triundecyl benzene-1,2,4-tricarboxylate

Systemtic Name: triundecyl benzene-1,2,4-tricarboxylate Openeye Name: triundecyl benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid triundecyl ester IUPAC Name: triundecyl benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid triundecyl ester Formula: C42H72O6 MolecularWeight: 673.01748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCCCCC)C(=O)OCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCCCCC)C(=O)OCCCCCCCCCCC

InChI

InChI=1S/C42H72O6/c1-4-7-10-13-16-19-22-25-28-33-46-40(43)37-31-32-38(41(44)47-34-29-26-23-20-17-14-11-8-5-2)39(36-37)42(45)48-35-30-27-24-21-18-15-12-9-6-3/h31-32,36H,4-30,33-35H2,1-3H3