propyl 5-[4,6-bis(5-oxidanylidene-5-propoxy-pentyl)-1,3,5-trioxan-2-yl]pentanoate

Systemtic Name: propyl 5-[4,6-bis(5-oxidanylidene-5-propoxy-pentyl)-1,3,5-trioxan-2-yl]pentanoate Openeye Name: propyl 5-[4,6-bis(5-oxo-5-propoxy-pentyl)-1,3,5-trioxan-2-yl]pentanoate CAS Name: 5-[4,6-bis(5-oxo-5-propoxypentyl)-1,3,5-trioxan-2-yl]pentanoic acid propyl ester IUPAC Name: propyl 5-[4,6-bis(5-oxo-5-propoxypentyl)-1,3,5-trioxan-2-yl]pentanoate Traditional Name: 5-[4,6-bis(5-keto-5-propoxy-pentyl)-1,3,5-trioxan-2-yl]valeric acid propyl ester Formula: C27H48O9 MolecularWeight: 516.66462

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCCCC1OC(OC(O1)CCCCC(=O)OCCC)CCCCC(=O)OCCC

Isomeric SMILES

CCCOC(=O)CCCCC1OC(OC(O1)CCCCC(=O)OCCC)CCCCC(=O)OCCC

InChI

InChI=1S/C27H48O9/c1-4-19-31-22(28)13-7-10-16-25-34-26(17-11-8-14-23(29)32-20-5-2)36-27(35-25)18-12-9-15-24(30)33-21-6-3/h25-27H,4-21H2,1-3H3