3-(3-oxidanylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one chloride

Systemtic Name: 3-(3-oxidanylpiperidin-1-ium-1-yl)-1-phenyl-propan-1-one chloride Openeye Name: 3-(3-hydroxypiperidin-1-ium-1-yl)-1-phenyl-propan-1-one chloride CAS Name: 3-(3-hydroxy-1-piperidin-1-iumyl)-1-phenyl-1-propanone chloride IUPAC Name: 3-(3-hydroxypiperidin-1-ium-1-yl)-1-phenylpropan-1-one chloride Traditional Name: 3-(3-hydroxypiperidin-1-ium-1-yl)-1-phenyl-propan-1-one chloride Formula: C14H20ClNO2 MolecularWeight: 269.7671

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCC(=O)C2=CC=CC=C2)O.[Cl-]

Isomeric SMILES

C1CC(C[NH+](C1)CCC(=O)C2=CC=CC=C2)O.[Cl-]

InChI

InChI=1S/C14H19NO2.ClH/c16-13-7-4-9-15(11-13)10-8-14(17)12-5-2-1-3-6-12;/h1-3,5-6,13,16H,4,7-11H2;1H