2-(1-chloranylisoquinolin-2-ium-2-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(1-chloranylisoquinolin-2-ium-2-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(1-chloroisoquinolin-2-ium-2-yl)-1-phenyl-ethanone bromide CAS Name: 2-(1-chloro-2-isoquinolin-2-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(1-chloroisoquinolin-2-ium-2-yl)-1-phenylethanone bromide Traditional Name: 2-(1-chloroisoquinolin-2-ium-2-yl)-1-phenyl-ethanone bromide Formula: C17H13BrClNO MolecularWeight: 362.64822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=C(C3=CC=CC=C3C=C2)Cl.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=C(C3=CC=CC=C3C=C2)Cl.[Br-]

InChI

InChI=1S/C17H13ClNO.BrH/c18-17-15-9-5-4-6-13(15)10-11-19(17)12-16(20)14-7-2-1-3-8-14;/h1-11H,12H2;1H/q+1;/p-1