[1-(octadecanoylamino)-2-oxidanyl-heptadecyl] octadecanoate

Systemtic Name: [1-(octadecanoylamino)-2-oxidanyl-heptadecyl] octadecanoate Openeye Name: [2-hydroxy-1-(octadecanoylamino)heptadecyl] octadecanoate CAS Name: octadecanoic acid [2-hydroxy-1-(1-oxooctadecylamino)heptadecyl] ester IUPAC Name: [2-hydroxy-1-(octadecanoylamino)heptadecyl] octadecanoate Traditional Name: stearic acid (2-hydroxy-1-stearamido-heptadecyl) ester Formula: C53H105NO4 MolecularWeight: 820.4051

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(C(CCCCCCCCCCCCCCC)O)OC(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(C(CCCCCCCCCCCCCCC)O)OC(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C53H105NO4/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-51(56)54-53(50(55)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)58-52(57)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h50,53,55H,4-49H2,1-3H3,(H,54,56)