tris(5-methylheptyl) benzene-1,2,4-tricarboxylate

Systemtic Name: tris(5-methylheptyl) benzene-1,2,4-tricarboxylate Openeye Name: tris(5-methylheptyl) benzene-1,2,4-tricarboxylate CAS Name: benzene-1,2,4-tricarboxylic acid tris(5-methylheptyl) ester IUPAC Name: tris(5-methylheptyl) benzene-1,2,4-tricarboxylate Traditional Name: benzene-1,2,4-tricarboxylic acid tris(5-methylheptyl) ester Formula: C33H54O6 MolecularWeight: 546.77826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCC(C)CC)C(=O)OCCCCC(C)CC

Isomeric SMILES

CCC(C)CCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCC(C)CC)C(=O)OCCCCC(C)CC

InChI

InChI=1S/C33H54O6/c1-7-25(4)16-10-13-21-37-31(34)28-19-20-29(32(35)38-22-14-11-17-26(5)8-2)30(24-28)33(36)39-23-15-12-18-27(6)9-3/h19-20,24-27H,7-18,21-23H2,1-6H3