N-[(4E,8E)-1,3-bis(oxidanyl)octadeca-4,8-dien-2-yl]-2-oxidanyl-tridecanamide

Systemtic Name: N-[(4E,8E)-1,3-bis(oxidanyl)octadeca-4,8-dien-2-yl]-2-oxidanyl-tridecanamide Openeye Name: 2-hydroxy-N-[(3E,7E)-2-hydroxy-1-(hydroxymethyl)heptadeca-3,7-dienyl]tridecanamide CAS Name: N-[(4E,8E)-1,3-dihydroxyoctadeca-4,8-dien-2-yl]-2-hydroxytridecanamide IUPAC Name: N-[(4E,8E)-1,3-dihydroxyoctadeca-4,8-dien-2-yl]-2-hydroxytridecanamide Traditional Name: 2-hydroxy-N-[(3E,7E)-2-hydroxy-1-methylol-heptadeca-3,7-dienyl]tridecanamide Formula: C31H59NO4 MolecularWeight: 509.80446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C(=O)NC(CO)C(C=CCCC=CCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCC(C(=O)NC(CO)C(/C=C/CC/C=C/CCCCCCCCC)O)O

InChI

InChI=1S/C31H59NO4/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-29(34)28(27-33)32-31(36)30(35)26-24-22-20-17-12-10-8-6-4-2/h16,18,23,25,28-30,33-35H,3-15,17,19-22,24,26-27H2,1-2H3,(H,32,36)/b18-16+,25-23+