2-methylbut-3-en-2-yl(octadecyl)azanium chloride

Systemtic Name: 2-methylbut-3-en-2-yl(octadecyl)azanium chloride Openeye Name: 1,1-dimethylallyl(octadecyl)ammonium chloride CAS Name: 2-methylbut-3-en-2-yl(octadecyl)ammonium chloride IUPAC Name: 2-methylbut-3-en-2-yl(octadecyl)azanium chloride Traditional Name: 1,1-dimethylallyl(stearyl)ammonium chloride Formula: C23H48ClN MolecularWeight: 374.08692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[NH2+]C(C)(C)C=C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[NH2+]C(C)(C)C=C.[Cl-]

InChI

InChI=1S/C23H47N.ClH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-23(3,4)6-2;/h6,24H,2,5,7-22H2,1,3-4H3;1H