1-[2-(3-bromanylphenoxy)ethyl]-1-methyl-pyrrolidin-1-ium iodide

Systemtic Name: 1-[2-(3-bromanylphenoxy)ethyl]-1-methyl-pyrrolidin-1-ium iodide Openeye Name: 1-[2-(3-bromophenoxy)ethyl]-1-methyl-pyrrolidin-1-ium iodide CAS Name: 1-[2-(3-bromophenoxy)ethyl]-1-methylpyrrolidin-1-ium iodide IUPAC Name: 1-[2-(3-bromophenoxy)ethyl]-1-methylpyrrolidin-1-ium iodide Traditional Name: 1-[2-(3-bromophenoxy)ethyl]-1-methyl-pyrrolidin-1-ium iodide Formula: C13H19BrINO MolecularWeight: 412.10453

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)CCOC2=CC(=CC=C2)Br.[I-]

Isomeric SMILES

C[N+]1(CCCC1)CCOC2=CC(=CC=C2)Br.[I-]

InChI

InChI=1S/C13H19BrNO.HI/c1-15(7-2-3-8-15)9-10-16-13-6-4-5-12(14)11-13;/h4-6,11H,2-3,7-10H2,1H3;1H/q+1;/p-1