(2-hexadecanoyloxy-3-oxidanyl-propyl) (9E,12E)-octadeca-9,12-dienoate

Systemtic Name: (2-hexadecanoyloxy-3-oxidanyl-propyl) (9E,12E)-octadeca-9,12-dienoate Openeye Name: (2-hexadecanoyloxy-3-hydroxy-propyl) (9E,12E)-octadeca-9,12-dienoate CAS Name: (9E,12E)-octadeca-9,12-dienoic acid [3-hydroxy-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: (2-hexadecanoyloxy-3-hydroxypropyl) (9E,12E)-octadeca-9,12-dienoate Traditional Name: (9E,12E)-octadeca-9,12-dienoic acid (2-hexadecanoyloxy-3-hydroxy-propyl) ester Formula: C37H68O5 MolecularWeight: 592.93282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCC/C=C/C/C=C/CCCCC

InChI

InChI=1S/C37H68O5/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-36(39)41-34-35(33-38)42-37(40)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,35,38H,3-10,12,14-16,19-34H2,1-2H3/b13-11+,18-17+