(E)-N-[(E,2S)-1,3-bis(oxidanyl)octadec-4-en-2-yl]tetracos-15-enamide

Systemtic Name: (E)-N-[(E,2S)-1,3-bis(oxidanyl)octadec-4-en-2-yl]tetracos-15-enamide Openeye Name: (E)-N-[(E,1S)-2-hydroxy-1-(hydroxymethyl)heptadec-3-enyl]tetracos-15-enamide CAS Name: (E)-N-[(E,2S)-1,3-dihydroxyoctadec-4-en-2-yl]-15-tetracosenamide IUPAC Name: (E)-N-[(E,2S)-1,3-dihydroxyoctadec-4-en-2-yl]tetracos-15-enamide Traditional Name: (E)-N-[(E,1S)-2-hydroxy-1-methylol-heptadec-3-enyl]tetracos-15-enamide Formula: C42H81NO3 MolecularWeight: 648.09744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(CO)NC(=O)CCCCCCCCCCCCCC=CCCCCCCCC)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C([C@H](CO)NC(=O)CCCCCCCCCCCCC/C=C/CCCCCCCC)O

InChI

InChI=1S/C42H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h17-18,35,37,40-41,44-45H,3-16,19-34,36,38-39H2,1-2H3,(H,43,46)/b18-17+,37-35+/t40-,41?/m0/s1