tridodecan-5-yl 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: tridodecan-5-yl 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: tris(1-butyloctyl) 2-hydroxypropane-1,2,3-tricarboxylate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid tridodecan-5-yl ester IUPAC Name: tridodecan-5-yl 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 2-hydroxypropane-1,2,3-tricarboxylic acid tris(1-butyloctyl) ester Formula: C42H80O7 MolecularWeight: 697.0804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCC)OC(=O)CC(CC(=O)OC(CCCC)CCCCCCC)(C(=O)OC(CCCC)CCCCCCC)O

Isomeric SMILES

CCCCCCCC(CCCC)OC(=O)CC(CC(=O)OC(CCCC)CCCCCCC)(C(=O)OC(CCCC)CCCCCCC)O

InChI

InChI=1S/C42H80O7/c1-7-13-19-22-25-31-36(28-16-10-4)47-39(43)34-42(46,41(45)49-38(30-18-12-6)33-27-24-21-15-9-3)35-40(44)48-37(29-17-11-5)32-26-23-20-14-8-2/h36-38,46H,7-35H2,1-6H3