ethanoic acid; N-[2-[2-(octadecanoylamino)ethylamino]ethyl]octadecanamide

Systemtic Name: ethanoic acid; N-[2-[2-(octadecanoylamino)ethylamino]ethyl]octadecanamide Openeye Name: acetic acid; N-[2-[2-(octadecanoylamino)ethylamino]ethyl]octadecanamide CAS Name: acetic acid; N-[2-[2-(1-oxooctadecylamino)ethylamino]ethyl]octadecanamide IUPAC Name: acetic acid; N-[2-[2-(octadecanoylamino)ethylamino]ethyl]octadecanamide Traditional Name: acetic acid; N-[2-(2-stearamidoethylamino)ethyl]stearamide Formula: C42H85N3O4 MolecularWeight: 696.142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCNCCNC(=O)CCCCCCCCCCCCCCCCC.CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCNCCNC(=O)CCCCCCCCCCCCCCCCC.CC(=O)O

InChI

InChI=1S/C40H81N3O2.C2H4O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39(44)42-37-35-41-36-38-43-40(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-2(3)4/h41H,3-38H2,1-2H3,(H,42,44)(H,43,45);1H3,(H,3,4)