trioctan-3-yl benzene-1,2,4-tricarboxylate

Systemtic Name: trioctan-3-yl benzene-1,2,4-tricarboxylate Openeye Name: tris(1-ethylhexyl) benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid trioctan-3-yl ester IUPAC Name: trioctan-3-yl benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid tris(1-ethylhexyl) ester Formula: C33H54O6 MolecularWeight: 546.77826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CC(=C(C=C1)C(=O)OC(CC)CCCCC)C(=O)OC(CC)CCCCC

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CC(=C(C=C1)C(=O)OC(CC)CCCCC)C(=O)OC(CC)CCCCC

InChI

InChI=1S/C33H54O6/c1-7-13-16-19-26(10-4)37-31(34)25-22-23-29(32(35)38-27(11-5)20-17-14-8-2)30(24-25)33(36)39-28(12-6)21-18-15-9-3/h22-24,26-28H,7-21H2,1-6H3