3-bromanyl-1-phenethyl-pyridin-1-ium iodide

Systemtic Name: 3-bromanyl-1-phenethyl-pyridin-1-ium iodide Openeye Name: 3-bromo-1-phenethyl-pyridin-1-ium iodide CAS Name: 3-bromo-1-phenethylpyridin-1-ium iodide IUPAC Name: 3-bromo-1-phenethylpyridin-1-ium iodide Traditional Name: 3-bromo-1-phenethyl-pyridin-1-ium iodide Formula: C13H13BrIN MolecularWeight: 390.05749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[N+]2=CC=CC(=C2)Br.[I-]

Isomeric SMILES

C1=CC=C(C=C1)CC[N+]2=CC=CC(=C2)Br.[I-]

InChI

InChI=1S/C13H13BrN.HI/c14-13-7-4-9-15(11-13)10-8-12-5-2-1-3-6-12;/h1-7,9,11H,8,10H2;1H/q+1;/p-1