(1-hexanoyloxy-3-oxidanyl-propan-2-yl) (9E,12E)-octadeca-9,12-dienoate

Systemtic Name: (1-hexanoyloxy-3-oxidanyl-propan-2-yl) (9E,12E)-octadeca-9,12-dienoate Openeye Name: [1-(hexanoyloxymethyl)-2-hydroxy-ethyl] (9E,12E)-octadeca-9,12-dienoate CAS Name: (9E,12E)-octadeca-9,12-dienoic acid [1-hydroxy-3-(1-oxohexoxy)propan-2-yl] ester IUPAC Name: (1-hexanoyloxy-3-hydroxypropan-2-yl) (9E,12E)-octadeca-9,12-dienoate Traditional Name: (9E,12E)-octadeca-9,12-dienoic acid [1-(caproyloxymethyl)-2-hydroxy-ethyl] ester Formula: C27H48O5 MolecularWeight: 452.66702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCC

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCC(=O)OC(CO)COC(=O)CCCCC

InChI

InChI=1S/C27H48O5/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-22-27(30)32-25(23-28)24-31-26(29)21-19-6-4-2/h9-10,12-13,25,28H,3-8,11,14-24H2,1-2H3/b10-9+,13-12+