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bis(phenylmethyl) 2-[3-(3-hexadecanoyloxyoctadecanoylamino)propanoylamino]pentanedioate

bis(phenylmethyl) 2-[3-(3-hexadecanoyloxyoctadecanoylamino)propanoylamino]pentanedioate

Systemtic Name:bis(phenylmethyl) 2-[3-(3-hexadecanoyloxyoctadecanoylamino)propanoylamino]pentanedioate
Openeye Name:dibenzyl 2-[3-(3-hexadecanoyloxyoctadecanoylamino)propanoylamino]pentanedioate
CAS Name:2-[[1-oxo-3-[[1-oxo-3-(1-oxohexadecoxy)octadecyl]amino]propyl]amino]pentanedioic acid bis(phenylmethyl) ester
IUPAC Name:dibenzyl 2-[3-(3-hexadecanoyloxyoctadecanoylamino)propanoylamino]pentanedioate
Traditional Name:2-[3-(3-hexadecanoyloxyoctadecanoylamino)propanoylamino]glutaric acid dibenzyl ester
Formula: C56H90N2O8
MolecularWeight: 919.3224
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC(=O)NCCC(=O)NC(CCC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)OC(=O)CCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCC(CC(=O)NCCC(=O)NC(CCC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)OC(=O)CCCCCCCCCCCCCCC


InChI

InChI=1S/C56H90N2O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-33-39-50(66-55(62)40-34-26-24-22-20-18-16-14-12-10-8-6-4-2)45-53(60)57-44-43-52(59)58-51(56(63)65-47-49-37-31-28-32-38-49)41-42-54(61)64-46-48-35-29-27-30-36-48/h27-32,35-38,50-51H,3-26,33-34,39-47H2,1-2H3,(H,57,60)(H,58,59)


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