(2,4-dichlorophenyl)methyl-octadecyl-azanium chloride

Systemtic Name: (2,4-dichlorophenyl)methyl-octadecyl-azanium chloride Openeye Name: (2,4-dichlorophenyl)methyl-octadecyl-ammonium chloride CAS Name: (2,4-dichlorophenyl)methyl-octadecylammonium chloride IUPAC Name: (2,4-dichlorophenyl)methyl-octadecylazanium chloride Traditional Name: (2,4-dichlorobenzyl)-stearyl-ammonium chloride Formula: C25H44Cl3N MolecularWeight: 464.98256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[NH2+]CC1=C(C=C(C=C1)Cl)Cl.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[NH2+]CC1=C(C=C(C=C1)Cl)Cl.[Cl-]

InChI

InChI=1S/C25H43Cl2N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28-22-23-18-19-24(26)21-25(23)27;/h18-19,21,28H,2-17,20,22H2,1H3;1H