(E)-1-(2-chlorophenyl)-5-piperidin-1-ium-1-yl-pent-1-en-3-one chloride

Systemtic Name: (E)-1-(2-chlorophenyl)-5-piperidin-1-ium-1-yl-pent-1-en-3-one chloride Openeye Name: (E)-1-(2-chlorophenyl)-5-piperidin-1-ium-1-yl-pent-1-en-3-one chloride CAS Name: (E)-1-(2-chlorophenyl)-5-(1-piperidin-1-iumyl)-1-penten-3-one chloride IUPAC Name: (E)-1-(2-chlorophenyl)-5-piperidin-1-ium-1-ylpent-1-en-3-one chloride Traditional Name: (E)-1-(2-chlorophenyl)-5-piperidin-1-ium-1-yl-pent-1-en-3-one chloride Formula: C16H21Cl2NO MolecularWeight: 314.25004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC(=O)C=CC2=CC=CC=C2Cl.[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C16H20ClNO.ClH/c17-16-7-3-2-6-14(16)8-9-15(19)10-13-18-11-4-1-5-12-18;/h2-3,6-9H,1,4-5,10-13H2;1H/b9-8+;