1-phenyl-3-piperidin-1-ium-1-yl-propan-1-one chloride

Systemtic Name: 1-phenyl-3-piperidin-1-ium-1-yl-propan-1-one chloride Openeye Name: 1-phenyl-3-piperidin-1-ium-1-yl-propan-1-one chloride CAS Name: 1-phenyl-3-(1-piperidin-1-iumyl)-1-propanone chloride IUPAC Name: 1-phenyl-3-piperidin-1-ium-1-ylpropan-1-one chloride Traditional Name: 1-phenyl-3-piperidin-1-ium-1-yl-propan-1-one chloride Formula: C14H20ClNO MolecularWeight: 253.7677

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO.ClH/c16-14(13-7-3-1-4-8-13)9-12-15-10-5-2-6-11-15;/h1,3-4,7-8H,2,5-6,9-12H2;1H