1-(1-bromanyl-3-chloranyl-2-methyl-propan-2-yl)pyridin-1-ium bromide

Systemtic Name: 1-(1-bromanyl-3-chloranyl-2-methyl-propan-2-yl)pyridin-1-ium bromide Openeye Name: 1-[1-(bromomethyl)-2-chloro-1-methyl-ethyl]pyridin-1-ium bromide CAS Name: 1-(1-bromo-3-chloro-2-methylpropan-2-yl)pyridin-1-ium bromide IUPAC Name: 1-(1-bromo-3-chloro-2-methylpropan-2-yl)pyridin-1-ium bromide Traditional Name: 1-[1-(bromomethyl)-2-chloro-1-methyl-ethyl]pyridin-1-ium bromide Formula: C9H12Br2ClN MolecularWeight: 329.45928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCl)(CBr)[N+]1=CC=CC=C1.[Br-]

Isomeric SMILES

CC(CCl)(CBr)[N+]1=CC=CC=C1.[Br-]

InChI

InChI=1S/C9H12BrClN.BrH/c1-9(7-10,8-11)12-5-3-2-4-6-12;/h2-6H,7-8H2,1H3;1H/q+1;/p-1