N-[2-[4-bromanyl-2,5-bis(chloranyl)phenoxy]ethyl]pyridin-1-ium-2-amine

Systemtic Name: N-[2-[4-bromanyl-2,5-bis(chloranyl)phenoxy]ethyl]pyridin-1-ium-2-amine Openeye Name: N-[2-(4-bromo-2,5-dichloro-phenoxy)ethyl]pyridin-1-ium-2-amine CAS Name: N-[2-(4-bromo-2,5-dichlorophenoxy)ethyl]-2-pyridin-1-iumamine IUPAC Name: N-[2-(4-bromo-2,5-dichlorophenoxy)ethyl]pyridin-1-ium-2-amine Traditional Name: 2-(4-bromo-2,5-dichloro-phenoxy)ethyl-pyridin-1-ium-2-yl-amine Formula: C13H12BrCl2N2O+ MolecularWeight: 363.05718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NCCOC2=CC(=C(C=C2Cl)Br)Cl

Isomeric SMILES

C1=CC=[NH+]C(=C1)NCCOC2=CC(=C(C=C2Cl)Br)Cl

InChI

InChI=1S/C13H11BrCl2N2O/c14-9-7-11(16)12(8-10(9)15)19-6-5-18-13-3-1-2-4-17-13/h1-4,7-8H,5-6H2,(H,17,18)/p+1