3-[2-(3-chlorophenyl)ethyl]pyridin-1-ium-2-carboxylic acid chloride

Systemtic Name: 3-[2-(3-chlorophenyl)ethyl]pyridin-1-ium-2-carboxylic acid chloride Openeye Name: 3-[2-(3-chlorophenyl)ethyl]pyridin-1-ium-2-carboxylic acid chloride CAS Name: 3-[2-(3-chlorophenyl)ethyl]-2-pyridin-1-iumcarboxylic acid chloride IUPAC Name: 3-[2-(3-chlorophenyl)ethyl]pyridin-1-ium-2-carboxylic acid chloride Traditional Name: 3-[2-(3-chlorophenyl)ethyl]pyridin-1-ium-2-carboxylic acid chloride Formula: C14H13Cl2NO2 MolecularWeight: 298.16452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCC2=C([NH+]=CC=C2)C(=O)O.[Cl-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCC2=C([NH+]=CC=C2)C(=O)O.[Cl-]

InChI

InChI=1S/C14H12ClNO2.ClH/c15-12-5-1-3-10(9-12)6-7-11-4-2-8-16-13(11)14(17)18;/h1-5,8-9H,6-7H2,(H,17,18);1H