[2-henicosyl-4-(hydroxymethyl)-5H-1,3-oxazol-4-yl]methyl docosanoate

Systemtic Name: [2-henicosyl-4-(hydroxymethyl)-5H-1,3-oxazol-4-yl]methyl docosanoate Openeye Name: [2-henicosyl-4-(hydroxymethyl)-5H-oxazol-4-yl]methyl docosanoate CAS Name: docosanoic acid [2-heneicosyl-4-(hydroxymethyl)-5H-oxazol-4-yl]methyl ester IUPAC Name: [2-henicosyl-4-(hydroxymethyl)-5H-1,3-oxazol-4-yl]methyl docosanoate Traditional Name: behenic acid (2-heneicosyl-4-methylol-2-oxazolin-4-yl)methyl ester Formula: C48H93NO4 MolecularWeight: 748.25632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC1=NC(CO1)(CO)COC(=O)CCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC1=NC(CO1)(CO)COC(=O)CCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C48H93NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-46-49-48(43-50,44-52-46)45-53-47(51)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h50H,3-45H2,1-2H3