dimethyl-[2-(2-nonan-2-ylphenoxy)ethyl]-(phenylmethyl)azanium chloride

Systemtic Name: dimethyl-[2-(2-nonan-2-ylphenoxy)ethyl]-(phenylmethyl)azanium chloride Openeye Name: benzyl-dimethyl-[2-[2-(1-methyloctyl)phenoxy]ethyl]ammonium chloride CAS Name: dimethyl-[2-(2-nonan-2-ylphenoxy)ethyl]-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-dimethyl-[2-(2-nonan-2-ylphenoxy)ethyl]azanium chloride Traditional Name: benzyl-dimethyl-[2-[2-(1-methyloctyl)phenoxy]ethyl]ammonium chloride Formula: C26H40ClNO MolecularWeight: 418.0549

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C)C1=CC=CC=C1OCC[N+](C)(C)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCCCC(C)C1=CC=CC=C1OCC[N+](C)(C)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C26H40NO.ClH/c1-5-6-7-8-10-15-23(2)25-18-13-14-19-26(25)28-21-20-27(3,4)22-24-16-11-9-12-17-24;/h9,11-14,16-19,23H,5-8,10,15,20-22H2,1-4H3;1H/q+1;/p-1