1-[2-(2-bromanyl-4-chloranyl-phenyl)ethyl]pyridin-1-ium-2-amine

Systemtic Name: 1-[2-(2-bromanyl-4-chloranyl-phenyl)ethyl]pyridin-1-ium-2-amine Openeye Name: 1-[2-(2-bromo-4-chloro-phenyl)ethyl]pyridin-1-ium-2-amine CAS Name: 1-[2-(2-bromo-4-chlorophenyl)ethyl]-2-pyridin-1-iumamine IUPAC Name: 1-[2-(2-bromo-4-chlorophenyl)ethyl]pyridin-1-ium-2-amine Traditional Name: [1-[2-(2-bromo-4-chloro-phenyl)ethyl]pyridin-1-ium-2-yl]amine Formula: C13H13BrClN2+ MolecularWeight: 312.61272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)N)CCC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

C1=CC=[N+](C(=C1)N)CCC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C13H12BrClN2/c14-12-9-11(15)5-4-10(12)6-8-17-7-2-1-3-13(17)16/h1-5,7,9,16H,6,8H2/p+1