2-[2-(hexadecanoylamino)ethyl-dimethyl-azaniumyl]ethanoate

Systemtic Name: 2-[2-(hexadecanoylamino)ethyl-dimethyl-azaniumyl]ethanoate Openeye Name: 2-[2-(hexadecanoylamino)ethyl-dimethyl-ammonio]acetate CAS Name: 2-[dimethyl-[2-(1-oxohexadecylamino)ethyl]ammonio]acetate IUPAC Name: 2-[2-(hexadecanoylamino)ethyl-dimethylazaniumyl]acetate Traditional Name: 2-[dimethyl(2-palmitamidoethyl)ammonio]acetate Formula: C22H44N2O3 MolecularWeight: 384.59636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H44N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(25)23-18-19-24(2,3)20-22(26)27/h4-20H2,1-3H3,(H-,23,25,26,27)