(1-decanoyloxy-3-octanoyloxy-propan-2-yl) (9Z,12Z)-octadeca-9,12-dienoate

Systemtic Name: (1-decanoyloxy-3-octanoyloxy-propan-2-yl) (9Z,12Z)-octadeca-9,12-dienoate Openeye Name: [1-(decanoyloxymethyl)-2-octanoyloxy-ethyl] (9Z,12Z)-octadeca-9,12-dienoate CAS Name: (9Z,12Z)-octadeca-9,12-dienoic acid [1-(1-oxodecoxy)-3-(1-oxooctoxy)propan-2-yl] ester IUPAC Name: (1-decanoyloxy-3-octanoyloxypropan-2-yl) (9Z,12Z)-octadeca-9,12-dienoate Traditional Name: (9Z,12Z)-octadeca-9,12-dienoic acid [1-(capryloxymethyl)-2-caprylyloxy-ethyl] ester Formula: C39H70O6 MolecularWeight: 634.9695

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC

InChI

InChI=1S/C39H70O6/c1-4-7-10-13-15-16-17-18-19-20-21-22-24-27-30-33-39(42)45-36(34-43-37(40)31-28-25-12-9-6-3)35-44-38(41)32-29-26-23-14-11-8-5-2/h15-16,18-19,36H,4-14,17,20-35H2,1-3H3/b16-15-,19-18-