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

Systemtic Name: N-[2-(2-bromanyl-4-chloranyl-phenoxy)ethyl]pyridin-1-ium-2-amine Openeye Name: N-[2-(2-bromo-4-chloro-phenoxy)ethyl]pyridin-1-ium-2-amine CAS Name: N-[2-(2-bromo-4-chlorophenoxy)ethyl]-2-pyridin-1-iumamine IUPAC Name: N-[2-(2-bromo-4-chlorophenoxy)ethyl]pyridin-1-ium-2-amine Traditional Name: 2-(2-bromo-4-chloro-phenoxy)ethyl-pyridin-1-ium-2-yl-amine Formula: C13H13BrClN2O+ MolecularWeight: 328.61212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NCCOC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

C1=CC=[NH+]C(=C1)NCCOC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C13H12BrClN2O/c14-11-9-10(15)4-5-12(11)18-8-7-17-13-3-1-2-6-16-13/h1-6,9H,7-8H2,(H,16,17)/p+1