1-phenanthren-3-yl-2-piperidin-1-ium-1-yl-ethanol chloride

Systemtic Name: 1-phenanthren-3-yl-2-piperidin-1-ium-1-yl-ethanol chloride Openeye Name: 1-(3-phenanthryl)-2-piperidin-1-ium-1-yl-ethanol chloride CAS Name: 1-(3-phenanthrenyl)-2-(1-piperidin-1-iumyl)ethanol chloride IUPAC Name: 1-phenanthren-3-yl-2-piperidin-1-ium-1-ylethanol chloride Traditional Name: 1-(3-phenanthryl)-2-piperidin-1-ium-1-yl-ethanol chloride Formula: C21H24ClNO MolecularWeight: 341.87436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(C2=CC3=C(C=CC4=CC=CC=C43)C=C2)O.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CC(C2=CC3=C(C=CC4=CC=CC=C43)C=C2)O.[Cl-]

InChI

InChI=1S/C21H23NO.ClH/c23-21(15-22-12-4-1-5-13-22)18-11-10-17-9-8-16-6-2-3-7-19(16)20(17)14-18;/h2-3,6-11,14,21,23H,1,4-5,12-13,15H2;1H