trihexyl 2-oxidanyl-4-oxidanylidene-pentane-1,2,3-tricarboxylate

Systemtic Name: trihexyl 2-oxidanyl-4-oxidanylidene-pentane-1,2,3-tricarboxylate Openeye Name: trihexyl 2-hydroxy-4-oxo-pentane-1,2,3-tricarboxylate CAS Name: 2-hydroxy-4-oxopentane-1,2,3-tricarboxylic acid trihexyl ester IUPAC Name: trihexyl 2-hydroxy-4-oxopentane-1,2,3-tricarboxylate Traditional Name: 2-hydroxy-4-keto-pentane-1,2,3-tricarboxylic acid trihexyl ester Formula: C26H46O8 MolecularWeight: 486.63864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H46O8/c1-5-8-11-14-17-32-22(28)20-26(31,25(30)34-19-16-13-10-7-3)23(21(4)27)24(29)33-18-15-12-9-6-2/h23,31H,5-20H2,1-4H3