octadecyl (Z,12R)-12-octadecanoyloxyoctadec-9-enoate

Systemtic Name: octadecyl (Z,12R)-12-octadecanoyloxyoctadec-9-enoate Openeye Name: octadecyl (Z,12R)-12-octadecanoyloxyoctadec-9-enoate CAS Name: (Z,12R)-12-(1-oxooctadecoxy)-9-octadecenoic acid octadecyl ester IUPAC Name: octadecyl (Z,12R)-12-octadecanoyloxyoctadec-9-enoate Traditional Name: (Z,12R)-12-stearoyloxyoctadec-9-enoic acid stearyl ester Formula: C54H104O4 MolecularWeight: 817.40116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCC=CCC(CCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCC/C=C\C[C@@H](CCCCCC)OC(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C54H104O4/c1-4-7-10-13-15-17-19-21-23-25-27-29-33-37-41-46-51-57-53(55)49-44-39-35-32-31-34-38-43-48-52(47-42-12-9-6-3)58-54(56)50-45-40-36-30-28-26-24-22-20-18-16-14-11-8-5-2/h38,43,52H,4-37,39-42,44-51H2,1-3H3/b43-38-/t52-/m1/s1