3-[2,3-bis(oxidanyl)propyl]-N-hexadecyl-2-oxidanyl-octanamide

Systemtic Name: 3-[2,3-bis(oxidanyl)propyl]-N-hexadecyl-2-oxidanyl-octanamide Openeye Name: 3-(2,3-dihydroxypropyl)-N-hexadecyl-2-hydroxy-octanamide CAS Name: 3-(2,3-dihydroxypropyl)-N-hexadecyl-2-hydroxyoctanamide IUPAC Name: 3-(2,3-dihydroxypropyl)-N-hexadecyl-2-hydroxyoctanamide Traditional Name: N-cetyl-3-glyceryl-2-hydroxy-caprylamide Formula: C27H55NO4 MolecularWeight: 457.7299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)C(C(CCCCC)CC(CO)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)C(C(CCCCC)CC(CO)O)O

InChI

InChI=1S/C27H55NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-19-21-28-27(32)26(31)24(20-18-6-4-2)22-25(30)23-29/h24-26,29-31H,3-23H2,1-2H3,(H,28,32)