(E)-N-[6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]-N-octadecyl-octadec-9-enamide

Systemtic Name: (E)-N-[6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]-N-octadecyl-octadec-9-enamide Openeye Name: (E)-N-octadecyl-N-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)octadec-9-enamide CAS Name: (E)-N-octadecyl-N-(3,4,5-trihydroxy-6-methyl-2-oxanyl)-9-octadecenamide IUPAC Name: (E)-N-octadecyl-N-(3,4,5-trihydroxy-6-methyloxan-2-yl)octadec-9-enamide Traditional Name: (E)-N-stearyl-N-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)octadec-9-enamide Formula: C42H81NO5 MolecularWeight: 680.09624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C1C(C(C(C(O1)C)O)O)O)C(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C1C(C(C(C(O1)C)O)O)O)C(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C42H81NO5/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(42-41(47)40(46)39(45)37(3)48-42)38(44)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h19,21,37,39-42,45-47H,4-18,20,22-36H2,1-3H3/b21-19+