dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]-octadecyl-azanium; methyl sulfate

Systemtic Name: dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]-octadecyl-azanium; methyl sulfate Openeye Name: dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]-octadecyl-ammonium; methyl sulfate CAS Name: dimethyl-[2-(2-methyl-1-oxoprop-2-enoxy)ethyl]-octadecylammonium; methyl sulfate IUPAC Name: dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]-octadecylazanium; methyl sulfate Traditional Name: 2-methacryloyloxyethyl-dimethyl-stearyl-ammonium; methyl sulfate Formula: C27H55NO6S MolecularWeight: 521.7937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCOC(=O)C(=C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCOC(=O)C(=C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C26H52NO2.CH4O4S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-27(4,5)23-24-29-26(28)25(2)3;1-5-6(2,3)4/h2,6-24H2,1,3-5H3;1H3,(H,2,3,4)/q+1;/p-1