[16-[1,3-bis(oxidanyl)octadecan-2-ylamino]-16-oxidanylidene-hexadecyl] hexadecanoate

Systemtic Name: [16-[1,3-bis(oxidanyl)octadecan-2-ylamino]-16-oxidanylidene-hexadecyl] hexadecanoate Openeye Name: [16-[[2-hydroxy-1-(hydroxymethyl)heptadecyl]amino]-16-oxo-hexadecyl] hexadecanoate CAS Name: hexadecanoic acid [16-(1,3-dihydroxyoctadecan-2-ylamino)-16-oxohexadecyl] ester IUPAC Name: [16-(1,3-dihydroxyoctadecan-2-ylamino)-16-oxohexadecyl] hexadecanoate Traditional Name: palmitic acid [16-[(2-hydroxy-1-methylol-heptadecyl)amino]-16-keto-hexadecyl] ester Formula: C50H99NO5 MolecularWeight: 794.32476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(CO)NC(=O)CCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(C(CO)NC(=O)CCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCC)O

InChI

InChI=1S/C50H99NO5/c1-3-5-7-9-11-13-15-18-22-26-30-34-38-42-48(53)47(46-52)51-49(54)43-39-35-31-27-23-20-17-21-25-29-33-37-41-45-56-50(55)44-40-36-32-28-24-19-16-14-12-10-8-6-4-2/h47-48,52-53H,3-46H2,1-2H3,(H,51,54)