5-(5-bromanylisoquinolin-2-ium-2-yl)pentanal iodide

Systemtic Name: 5-(5-bromanylisoquinolin-2-ium-2-yl)pentanal iodide Openeye Name: 5-(5-bromoisoquinolin-2-ium-2-yl)pentanal iodide CAS Name: 5-(5-bromo-2-isoquinolin-2-iumyl)pentanal iodide IUPAC Name: 5-(5-bromoisoquinolin-2-ium-2-yl)pentanal iodide Traditional Name: 5-(5-bromoisoquinolin-2-ium-2-yl)valeraldehyde iodide Formula: C14H15BrINO MolecularWeight: 420.08347

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C[N+](=C2)CCCCC=O)C(=C1)Br.[I-]

Isomeric SMILES

C1=CC2=C(C=C[N+](=C2)CCCCC=O)C(=C1)Br.[I-]

InChI

InChI=1S/C14H15BrNO.HI/c15-14-6-4-5-12-11-16(9-7-13(12)14)8-2-1-3-10-17;/h4-7,9-11H,1-3,8H2;1H/q+1;/p-1