dimethyl-[2-oxidanyl-3-[2-(5-phenylpentyl)phenoxy]propyl]azanium chloride

Systemtic Name: dimethyl-[2-oxidanyl-3-[2-(5-phenylpentyl)phenoxy]propyl]azanium chloride Openeye Name: [2-hydroxy-3-[2-(5-phenylpentyl)phenoxy]propyl]-dimethyl-ammonium chloride CAS Name: [2-hydroxy-3-[2-(5-phenylpentyl)phenoxy]propyl]-dimethylammonium chloride IUPAC Name: [2-hydroxy-3-[2-(5-phenylpentyl)phenoxy]propyl]-dimethylazanium chloride Traditional Name: [2-hydroxy-3-[2-(5-phenylpentyl)phenoxy]propyl]-dimethyl-ammonium chloride Formula: C22H32ClNO2 MolecularWeight: 377.94798

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(COC1=CC=CC=C1CCCCCC2=CC=CC=C2)O.[Cl-]

Isomeric SMILES

C[NH+](C)CC(COC1=CC=CC=C1CCCCCC2=CC=CC=C2)O.[Cl-]

InChI

InChI=1S/C22H31NO2.ClH/c1-23(2)17-21(24)18-25-22-16-10-9-15-20(22)14-8-4-7-13-19-11-5-3-6-12-19;/h3,5-6,9-12,15-16,21,24H,4,7-8,13-14,17-18H2,1-2H3;1H