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2-heptanoyloxypropyl (6E,9E,12E)-octadeca-6,9,12-trienoate

2-heptanoyloxypropyl (6E,9E,12E)-octadeca-6,9,12-trienoate

Systemtic Name:2-heptanoyloxypropyl (6E,9E,12E)-octadeca-6,9,12-trienoate
Openeye Name:2-heptanoyloxypropyl (6E,9E,12E)-octadeca-6,9,12-trienoate
CAS Name:(6E,9E,12E)-octadeca-6,9,12-trienoic acid 2-(1-oxoheptoxy)propyl ester
IUPAC Name:2-heptanoyloxypropyl (6E,9E,12E)-octadeca-6,9,12-trienoate
Traditional Name:(6E,9E,12E)-octadeca-6,9,12-trienoic acid 2-enanthyloxypropyl ester
Formula: C28H48O4
MolecularWeight: 448.67832
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC(C)COC(=O)CCCCC=CCC=CCC=CCCCCC


Isomeric SMILES

CCCCCCC(=O)OC(C)COC(=O)CCCC/C=C/C/C=C/C/C=C/CCCCC


InChI

InChI=1S/C28H48O4/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-22-23-27(29)31-25-26(3)32-28(30)24-21-9-7-5-2/h11-12,14-15,17-18,26H,4-10,13,16,19-25H2,1-3H3/b12-11+,15-14+,18-17+


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