hexadecyl-dimethyl-phenethyl-azanium chloride

Systemtic Name: hexadecyl-dimethyl-phenethyl-azanium chloride Openeye Name: hexadecyl-dimethyl-phenethyl-ammonium chloride CAS Name: hexadecyl-dimethyl-phenethylammonium chloride IUPAC Name: hexadecyl-dimethyl-phenethylazanium chloride Traditional Name: cetyl-dimethyl-phenethyl-ammonium chloride Formula: C26H48ClN MolecularWeight: 410.11902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCC1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCC1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C26H48N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24-27(2,3)25-23-26-21-18-17-19-22-26;/h17-19,21-22H,4-16,20,23-25H2,1-3H3;1H/q+1;/p-1