trihexyl 2-butanoyloxypropane-1,2,3-tricarboxylate

Systemtic Name: trihexyl 2-butanoyloxypropane-1,2,3-tricarboxylate Openeye Name: trihexyl 2-butanoyloxypropane-1,2,3-tricarboxylate CAS Name: 2-(1-oxobutoxy)propane-1,2,3-tricarboxylic acid trihexyl ester IUPAC Name: trihexyl 2-butanoyloxypropane-1,2,3-tricarboxylate Traditional Name: 2-butyryloxypropane-1,2,3-tricarboxylic acid trihexyl ester Formula: C28H50O8 MolecularWeight: 514.6918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(CC(=O)OCCCCCC)(C(=O)OCCCCCC)OC(=O)CCC

Isomeric SMILES

CCCCCCOC(=O)CC(CC(=O)OCCCCCC)(C(=O)OCCCCCC)OC(=O)CCC

InChI

InChI=1S/C28H50O8/c1-5-9-12-15-19-33-25(30)22-28(36-24(29)18-8-4,27(32)35-21-17-14-11-7-3)23-26(31)34-20-16-13-10-6-2/h5-23H2,1-4H3