16-[2-azanylpropyl-(16-decoxy-16-oxidanylidene-hexadecyl)amino]hexadecanoic acid

Systemtic Name: 16-[2-azanylpropyl-(16-decoxy-16-oxidanylidene-hexadecyl)amino]hexadecanoic acid Openeye Name: 16-[2-aminopropyl-(16-decoxy-16-oxo-hexadecyl)amino]hexadecanoic acid CAS Name: 16-[2-aminopropyl-(16-decoxy-16-oxohexadecyl)amino]hexadecanoic acid IUPAC Name: 16-[2-aminopropyl-(16-decoxy-16-oxohexadecyl)amino]hexadecanoic acid Traditional Name: 16-[2-aminopropyl-(16-decoxy-16-keto-hexadecyl)amino]palmitic acid Formula: C45H90N2O4 MolecularWeight: 723.2071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC(=O)O)CC(C)N

Isomeric SMILES

CCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC(=O)O)CC(C)N

InChI

InChI=1S/C45H90N2O4/c1-3-4-5-6-7-26-31-36-41-51-45(50)38-33-28-23-19-15-11-9-13-17-21-25-30-35-40-47(42-43(2)46)39-34-29-24-20-16-12-8-10-14-18-22-27-32-37-44(48)49/h43H,3-42,46H2,1-2H3,(H,48,49)