N-(5-bromanylpyridin-2-yl)-2-ethenyl-1-ethyl-6-methyl-pyridin-1-ium-3-amine iodide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-ethenyl-1-ethyl-6-methyl-pyridin-1-ium-3-amine iodide Openeye Name: N-(5-bromo-2-pyridyl)-1-ethyl-6-methyl-2-vinyl-pyridin-1-ium-3-amine iodide CAS Name: N-(5-bromo-2-pyridinyl)-2-ethenyl-1-ethyl-6-methyl-3-pyridin-1-iumamine iodide IUPAC Name: N-(5-bromopyridin-2-yl)-2-ethenyl-1-ethyl-6-methylpyridin-1-ium-3-amine iodide Traditional Name: (5-bromo-2-pyridyl)-(1-ethyl-6-methyl-2-vinyl-pyridin-1-ium-3-yl)amine iodide Formula: C15H17BrIN3 MolecularWeight: 446.12405

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=CC(=C1C=C)NC2=NC=C(C=C2)Br)C.[I-]

Isomeric SMILES

CC[N+]1=C(C=CC(=C1C=C)NC2=NC=C(C=C2)Br)C.[I-]

InChI

InChI=1S/C15H17BrN3.HI/c1-4-14-13(8-6-11(3)19(14)5-2)18-15-9-7-12(16)10-17-15;/h4,6-10H,1,5H2,2-3H3,(H,17,18);1H/q+1;/p-1