N-[(E)-1,3-bis(oxidanyl)octadec-4-en-2-yl]-2-oxidanyl-hexadecanamide

Systemtic Name: N-[(E)-1,3-bis(oxidanyl)octadec-4-en-2-yl]-2-oxidanyl-hexadecanamide Openeye Name: 2-hydroxy-N-[(E)-2-hydroxy-1-(hydroxymethyl)heptadec-3-enyl]hexadecanamide CAS Name: N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]-2-hydroxyhexadecanamide IUPAC Name: N-[(E)-1,3-dihydroxyoctadec-4-en-2-yl]-2-hydroxyhexadecanamide Traditional Name: 2-hydroxy-N-[(E)-2-hydroxy-1-methylol-heptadec-3-enyl]palmitamide Formula: C34H67NO4 MolecularWeight: 553.90008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(=O)NC(CO)C(C=CCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCC(C(=O)NC(CO)C(/C=C/CCCCCCCCCCCCC)O)O

InChI

InChI=1S/C34H67NO4/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-32(37)31(30-36)35-34(39)33(38)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h26,28,31-33,36-38H,3-25,27,29-30H2,1-2H3,(H,35,39)/b28-26+