N-[(E)-1,3-bis(oxidanyl)octadec-4-enyl]tetracosanamide

Systemtic Name: N-[(E)-1,3-bis(oxidanyl)octadec-4-enyl]tetracosanamide Openeye Name: N-[(E)-1,3-dihydroxyoctadec-4-enyl]tetracosanamide CAS Name: N-[(E)-1,3-dihydroxyoctadec-4-enyl]tetracosanamide IUPAC Name: N-[(E)-1,3-dihydroxyoctadec-4-enyl]tetracosanamide Traditional Name: N-[(E)-1,3-dihydroxyoctadec-4-enyl]lignoceramide Formula: C42H83NO3 MolecularWeight: 650.11332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC(C=CCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CC(/C=C/CCCCCCCCCCCCC)O)O

InChI

InChI=1S/C42H83NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-41(45)43-42(46)39-40(44)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h35,37,40,42,44,46H,3-34,36,38-39H2,1-2H3,(H,43,45)/b37-35+