2-[2-(dihexadecylamino)-2-oxidanylidene-ethyl]octadecanoic acid

Systemtic Name: 2-[2-(dihexadecylamino)-2-oxidanylidene-ethyl]octadecanoic acid Openeye Name: 2-[2-(dihexadecylamino)-2-oxo-ethyl]octadecanoic acid CAS Name: 2-[2-(dihexadecylamino)-2-oxoethyl]octadecanoic acid IUPAC Name: 2-[2-(dihexadecylamino)-2-oxoethyl]octadecanoic acid Traditional Name: 2-[2-(dicetylamino)-2-keto-ethyl]stearic acid Formula: C52H103NO3 MolecularWeight: 790.37912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(=O)N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(=O)N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)C(=O)O

InChI

InChI=1S/C52H103NO3/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-50(52(55)56)49-51(54)53(47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h50H,4-49H2,1-3H3,(H,55,56)