4-[(4-chloranylpyridin-1-ium-1-yl)methyl]benzoic acid bromide

Systemtic Name: 4-[(4-chloranylpyridin-1-ium-1-yl)methyl]benzoic acid bromide Openeye Name: 4-[(4-chloropyridin-1-ium-1-yl)methyl]benzoic acid bromide CAS Name: 4-[(4-chloro-1-pyridin-1-iumyl)methyl]benzoic acid bromide IUPAC Name: 4-[(4-chloropyridin-1-ium-1-yl)methyl]benzoic acid bromide Traditional Name: 4-[(4-chloropyridin-1-ium-1-yl)methyl]benzoic acid bromide Formula: C13H11BrClNO2 MolecularWeight: 328.58894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[N+]2=CC=C(C=C2)Cl)C(=O)O.[Br-]

Isomeric SMILES

C1=CC(=CC=C1C[N+]2=CC=C(C=C2)Cl)C(=O)O.[Br-]

InChI

InChI=1S/C13H10ClNO2.BrH/c14-12-5-7-15(8-6-12)9-10-1-3-11(4-2-10)13(16)17;/h1-8H,9H2;1H