16-[2-azanylethyl-(16-dodecoxy-16-oxidanylidene-hexadecyl)amino]hexadecanoic acid

Systemtic Name: 16-[2-azanylethyl-(16-dodecoxy-16-oxidanylidene-hexadecyl)amino]hexadecanoic acid Openeye Name: 16-[2-aminoethyl-(16-dodecoxy-16-oxo-hexadecyl)amino]hexadecanoic acid CAS Name: 16-[2-aminoethyl-(16-dodecoxy-16-oxohexadecyl)amino]hexadecanoic acid IUPAC Name: 16-[2-aminoethyl-(16-dodecoxy-16-oxohexadecyl)amino]hexadecanoic acid Traditional Name: 16-[2-aminoethyl-(16-keto-16-lauryloxy-hexadecyl)amino]palmitic acid Formula: C46H92N2O4 MolecularWeight: 737.23368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC(=O)O)CCN

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC(=O)O)CCN

InChI

InChI=1S/C46H92N2O4/c1-2-3-4-5-6-7-22-27-32-37-44-52-46(51)39-34-29-24-19-15-11-9-13-17-21-26-31-36-42-48(43-40-47)41-35-30-25-20-16-12-8-10-14-18-23-28-33-38-45(49)50/h2-44,47H2,1H3,(H,49,50)