2-(hexadecanoylamino)ethyl-dimethyl-prop-2-ynyl-azanium bromide

Systemtic Name: 2-(hexadecanoylamino)ethyl-dimethyl-prop-2-ynyl-azanium bromide Openeye Name: 2-(hexadecanoylamino)ethyl-dimethyl-prop-2-ynyl-ammonium bromide CAS Name: dimethyl-[2-(1-oxohexadecylamino)ethyl]-prop-2-ynylammonium bromide IUPAC Name: 2-(hexadecanoylamino)ethyl-dimethyl-prop-2-ynylazanium bromide Traditional Name: dimethyl-(2-palmitamidoethyl)-propargyl-ammonium bromide Formula: C23H45BrN2O MolecularWeight: 445.5202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NCC[N+](C)(C)CC#C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NCC[N+](C)(C)CC#C.[Br-]

InChI

InChI=1S/C23H44N2O.BrH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)24-20-22-25(3,4)21-6-2;/h2H,5,7-22H2,1,3-4H3;1H