dibutyl-[2-(2-phenoxyethoxy)ethyl]-(2-phenylpropan-2-yl)azanium chloride

Systemtic Name: dibutyl-[2-(2-phenoxyethoxy)ethyl]-(2-phenylpropan-2-yl)azanium chloride Openeye Name: dibutyl-(1-methyl-1-phenyl-ethyl)-[2-(2-phenoxyethoxy)ethyl]ammonium chloride CAS Name: dibutyl-[2-(2-phenoxyethoxy)ethyl]-(2-phenylpropan-2-yl)ammonium chloride IUPAC Name: dibutyl-[2-(2-phenoxyethoxy)ethyl]-(2-phenylpropan-2-yl)azanium chloride Traditional Name: dibutyl-cumyl-[2-(2-phenoxyethoxy)ethyl]ammonium chloride Formula: C27H42ClNO2 MolecularWeight: 448.08088

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(CCOCCOC1=CC=CC=C1)C(C)(C)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCC[N+](CCCC)(CCOCCOC1=CC=CC=C1)C(C)(C)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C27H42NO2.ClH/c1-5-7-19-28(20-8-6-2,27(3,4)25-15-11-9-12-16-25)21-22-29-23-24-30-26-17-13-10-14-18-26;/h9-18H,5-8,19-24H2,1-4H3;1H/q+1;/p-1