diethyl-[2-(hexadecanoylamino)ethyl]-methyl-azanium; methyl sulfate

Systemtic Name: diethyl-[2-(hexadecanoylamino)ethyl]-methyl-azanium; methyl sulfate Openeye Name: diethyl-[2-(hexadecanoylamino)ethyl]-methyl-ammonium; methyl sulfate CAS Name: diethyl-methyl-[2-(1-oxohexadecylamino)ethyl]ammonium; methyl sulfate IUPAC Name: diethyl-[2-(hexadecanoylamino)ethyl]-methylazanium; methyl sulfate Traditional Name: diethyl-methyl-(2-palmitamidoethyl)ammonium; methyl sulfate Formula: C24H52N2O5S MolecularWeight: 480.74508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H48N2O.CH4O4S/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-23(26)24-21-22-25(4,6-2)7-3;1-5-6(2,3)4/h5-22H2,1-4H3;1H3,(H,2,3,4)