[2,6-dimethyl-4-[2-(2-methylphenoxy)ethoxymethyl]heptan-4-yl]-dimethyl-azanium chloride

Systemtic Name: [2,6-dimethyl-4-[2-(2-methylphenoxy)ethoxymethyl]heptan-4-yl]-dimethyl-azanium chloride Openeye Name: [1-isobutyl-3-methyl-1-[2-(2-methylphenoxy)ethoxymethyl]butyl]-dimethyl-ammonium chloride CAS Name: [2,6-dimethyl-4-[2-(2-methylphenoxy)ethoxymethyl]heptan-4-yl]-dimethylammonium chloride IUPAC Name: [2,6-dimethyl-4-[2-(2-methylphenoxy)ethoxymethyl]heptan-4-yl]-dimethylazanium chloride Traditional Name: [1-isobutyl-3-methyl-1-[2-(2-methylphenoxy)ethoxymethyl]butyl]-dimethyl-ammonium chloride Formula: C21H38ClNO2 MolecularWeight: 371.98492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCOCC(CC(C)C)(CC(C)C)[NH+](C)C.[Cl-]

Isomeric SMILES

CC1=CC=CC=C1OCCOCC(CC(C)C)(CC(C)C)[NH+](C)C.[Cl-]

InChI

InChI=1S/C21H37NO2.ClH/c1-17(2)14-21(22(6)7,15-18(3)4)16-23-12-13-24-20-11-9-8-10-19(20)5;/h8-11,17-18H,12-16H2,1-7H3;1H