1-(2-chlorophenyl)-3-piperidin-1-ium-1-yl-propan-1-one chloride

Systemtic Name: 1-(2-chlorophenyl)-3-piperidin-1-ium-1-yl-propan-1-one chloride Openeye Name: 1-(2-chlorophenyl)-3-piperidin-1-ium-1-yl-propan-1-one chloride CAS Name: 1-(2-chlorophenyl)-3-(1-piperidin-1-iumyl)-1-propanone chloride IUPAC Name: 1-(2-chlorophenyl)-3-piperidin-1-ium-1-ylpropan-1-one chloride Traditional Name: 1-(2-chlorophenyl)-3-piperidin-1-ium-1-yl-propan-1-one chloride Formula: C14H19Cl2NO MolecularWeight: 288.21276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC(=O)C2=CC=CC=C2Cl.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CCC(=O)C2=CC=CC=C2Cl.[Cl-]

InChI

InChI=1S/C14H18ClNO.ClH/c15-13-7-3-2-6-12(13)14(17)8-11-16-9-4-1-5-10-16;/h2-3,6-7H,1,4-5,8-11H2;1H