1-phenyl-6-piperidin-1-ium-1-yl-hex-2-yn-1-ol chloride

Systemtic Name: 1-phenyl-6-piperidin-1-ium-1-yl-hex-2-yn-1-ol chloride Openeye Name: 1-phenyl-6-piperidin-1-ium-1-yl-hex-2-yn-1-ol chloride CAS Name: 1-phenyl-6-(1-piperidin-1-iumyl)-2-hexyn-1-ol chloride IUPAC Name: 1-phenyl-6-piperidin-1-ium-1-ylhex-2-yn-1-ol chloride Traditional Name: 1-phenyl-6-piperidin-1-ium-1-yl-hex-2-yn-1-ol chloride Formula: C17H24ClNO MolecularWeight: 293.83156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCC#CC(C2=CC=CC=C2)O.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CCCC#CC(C2=CC=CC=C2)O.[Cl-]

InChI

InChI=1S/C17H23NO.ClH/c19-17(16-10-4-1-5-11-16)12-6-2-7-13-18-14-8-3-9-15-18;/h1,4-5,10-11,17,19H,2-3,7-9,13-15H2;1H