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

Systemtic Name: 16-[2-azanylethyl-(16-octoxy-16-oxidanylidene-hexadecyl)amino]hexadecanoic acid Openeye Name: 16-[2-aminoethyl-(16-octoxy-16-oxo-hexadecyl)amino]hexadecanoic acid CAS Name: 16-[2-aminoethyl-(16-octoxy-16-oxohexadecyl)amino]hexadecanoic acid IUPAC Name: 16-[2-aminoethyl-(16-octoxy-16-oxohexadecyl)amino]hexadecanoic acid Traditional Name: 16-[2-aminoethyl-(16-keto-16-octoxy-hexadecyl)amino]palmitic acid Formula: C42H84N2O4 MolecularWeight: 681.12736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC(=O)O)CCN

Isomeric SMILES

CCCCCCCCOC(=O)CCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC(=O)O)CCN

InChI

InChI=1S/C42H84N2O4/c1-2-3-4-5-28-33-40-48-42(47)35-30-25-21-17-13-9-7-11-15-19-23-27-32-38-44(39-36-43)37-31-26-22-18-14-10-6-8-12-16-20-24-29-34-41(45)46/h2-40,43H2,1H3,(H,45,46)