2-[(E)-12-oxidanyloctadec-9-enoyl]oxypropyl (E)-12-oxidanyloctadec-9-enoate

Systemtic Name: 2-[(E)-12-oxidanyloctadec-9-enoyl]oxypropyl (E)-12-oxidanyloctadec-9-enoate Openeye Name: 2-[(E)-12-hydroxyoctadec-9-enoyl]oxypropyl (E)-12-hydroxyoctadec-9-enoate CAS Name: (E)-12-hydroxy-9-octadecenoic acid 2-[(E)-12-hydroxy-1-oxooctadec-9-enoxy]propyl ester IUPAC Name: 2-[(E)-12-hydroxyoctadec-9-enoyl]oxypropyl (E)-12-hydroxyoctadec-9-enoate Traditional Name: (E)-12-hydroxyoctadec-9-enoic acid 2-[(E)-12-hydroxyoctadec-9-enoyl]oxypropyl ester Formula: C39H72O6 MolecularWeight: 636.98538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)OCC(C)OC(=O)CCCCCCCC=CCC(CCCCCC)O)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC(=O)OCC(C)OC(=O)CCCCCCC/C=C/CC(CCCCCC)O)O

InChI

InChI=1S/C39H72O6/c1-4-6-8-22-28-36(40)30-24-18-14-10-12-16-20-26-32-38(42)44-34-35(3)45-39(43)33-27-21-17-13-11-15-19-25-31-37(41)29-23-9-7-5-2/h18-19,24-25,35-37,40-41H,4-17,20-23,26-34H2,1-3H3/b24-18+,25-19+