[2-ethyl-3-[8-(3-octyloxiran-2-yl)octanoyloxy]hexyl] 8-(3-octyloxiran-2-yl)octanoate

Systemtic Name: [2-ethyl-3-[8-(3-octyloxiran-2-yl)octanoyloxy]hexyl] 8-(3-octyloxiran-2-yl)octanoate Openeye Name: [2-ethyl-3-[8-(3-octyloxiran-2-yl)octanoyloxy]hexyl] 8-(3-octyloxiran-2-yl)octanoate CAS Name: 8-(3-octyl-2-oxiranyl)octanoic acid [2-ethyl-3-[8-(3-octyl-2-oxiranyl)-1-oxooctoxy]hexyl] ester IUPAC Name: [2-ethyl-3-[8-(3-octyloxiran-2-yl)octanoyloxy]hexyl] 8-(3-octyloxiran-2-yl)octanoate Traditional Name: 8-(3-octyloxiran-2-yl)caprylic acid [2-ethyl-3-[8-(3-octyloxiran-2-yl)octanoyloxy]hexyl] ester Formula: C44H82O6 MolecularWeight: 707.11828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(O1)CCCCCCCC(=O)OCC(CC)C(CCC)OC(=O)CCCCCCCC2C(O2)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1C(O1)CCCCCCCC(=O)OCC(CC)C(CCC)OC(=O)CCCCCCCC2C(O2)CCCCCCCC

InChI

InChI=1S/C44H82O6/c1-5-9-11-13-17-23-30-39-41(48-39)32-25-19-15-21-27-34-43(45)47-36-37(8-4)38(29-7-3)50-44(46)35-28-22-16-20-26-33-42-40(49-42)31-24-18-14-12-10-6-2/h37-42H,5-36H2,1-4H3