N-(6-acetamidohexyl)-12,13-dihexyl-N'-[6-(nonatetracontanoylamino)hexyl]tetracosanediamide

Systemtic Name: N-(6-acetamidohexyl)-12,13-dihexyl-N'-[6-(nonatetracontanoylamino)hexyl]tetracosanediamide Openeye Name: N-(6-acetamidohexyl)-12,13-dihexyl-N'-[6-(nonatetracontanoylamino)hexyl]tetracosanediamide CAS Name: N-(6-acetamidohexyl)-12,13-dihexyl-N'-[6-(1-oxononatetracontylamino)hexyl]tetracosanediamide IUPAC Name: N-(6-acetamidohexyl)-12,13-dihexyl-N'-[6-(nonatetracontanoylamino)hexyl]tetracosanediamide Traditional Name: N-(6-acetamidohexyl)-12,13-dihexyl-N'-[6-(nonatetracontanoylamino)hexyl]tetracosanediamide Formula: C99H196N4O4 MolecularWeight: 1506.63994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCCCCCNC(=O)CCCCCCCCCCC(CCCCCC)C(CCCCCC)CCCCCCCCCCC(=O)NCCCCCCNC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCCCCCNC(=O)CCCCCCCCCCC(CCCCCC)C(CCCCCC)CCCCCCCCCCC(=O)NCCCCCCNC(=O)C

InChI

InChI=1S/C99H196N4O4/c1-5-8-11-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-39-40-41-42-43-44-45-46-47-48-49-50-51-52-53-60-65-76-87-98(106)102-92-81-70-71-82-93-103-99(107)89-78-67-62-57-55-59-64-75-86-96(84-73-13-10-7-3)95(83-72-12-9-6-2)85-74-63-58-54-56-61-66-77-88-97(105)101-91-80-69-68-79-90-100-94(4)104/h95-96H,5-93H2,1-4H3,(H,100,104)(H,101,105)(H,102,106)(H,103,107)