dimethyl-[3-(2-methylprop-2-enoylamino)propyl]-octadecyl-azanium chloride

Systemtic Name: dimethyl-[3-(2-methylprop-2-enoylamino)propyl]-octadecyl-azanium chloride Openeye Name: dimethyl-[3-(2-methylprop-2-enoylamino)propyl]-octadecyl-ammonium chloride CAS Name: dimethyl-[3-[(2-methyl-1-oxoprop-2-enyl)amino]propyl]-octadecylammonium chloride IUPAC Name: dimethyl-[3-(2-methylprop-2-enoylamino)propyl]-octadecylazanium chloride Traditional Name: 3-methacrylamidopropyl-dimethyl-stearyl-ammonium chloride Formula: C27H55ClN2O MolecularWeight: 459.1914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=O)C(=C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=O)C(=C)C.[Cl-]

InChI

InChI=1S/C27H54N2O.ClH/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-29(4,5)25-22-23-28-27(30)26(2)3;/h2,6-25H2,1,3-5H3;1H