tris(10-methylundecyl) benzene-1,3,5-tricarboxylate

Systemtic Name: tris(10-methylundecyl) benzene-1,3,5-tricarboxylate Openeye Name: tris(10-methylundecyl) benzene-1,3,5-tricarboxylate CAS Name: benzene-1,3,5-tricarboxylic acid tris(10-methylundecyl) ester IUPAC Name: tris(10-methylundecyl) benzene-1,3,5-tricarboxylate Traditional Name: benzene-1,3,5-tricarboxylic acid tris(10-methylundecyl) ester Formula: C45H78O6 MolecularWeight: 715.09722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCCCCCCCC(C)C)C(=O)OCCCCCCCCCC(C)C

Isomeric SMILES

CC(C)CCCCCCCCCOC(=O)C1=CC(=CC(=C1)C(=O)OCCCCCCCCCC(C)C)C(=O)OCCCCCCCCCC(C)C

InChI

InChI=1S/C45H78O6/c1-37(2)28-22-16-10-7-13-19-25-31-49-43(46)40-34-41(44(47)50-32-26-20-14-8-11-17-23-29-38(3)4)36-42(35-40)45(48)51-33-27-21-15-9-12-18-24-30-39(5)6/h34-39H,7-33H2,1-6H3