1-[2-(3-bromanylphenoxy)ethyl]pyridin-1-ium-3-carboxamide chloride

Systemtic Name: 1-[2-(3-bromanylphenoxy)ethyl]pyridin-1-ium-3-carboxamide chloride Openeye Name: 1-[2-(3-bromophenoxy)ethyl]pyridin-1-ium-3-carboxamide chloride CAS Name: 1-[2-(3-bromophenoxy)ethyl]-3-pyridin-1-iumcarboxamide chloride IUPAC Name: 1-[2-(3-bromophenoxy)ethyl]pyridin-1-ium-3-carboxamide chloride Traditional Name: 1-[2-(3-bromophenoxy)ethyl]pyridin-1-ium-3-carboxamide chloride Formula: C14H14BrClN2O2 MolecularWeight: 357.63016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCC[N+]2=CC=CC(=C2)C(=O)N.[Cl-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCC[N+]2=CC=CC(=C2)C(=O)N.[Cl-]

InChI

InChI=1S/C14H13BrN2O2.ClH/c15-12-4-1-5-13(9-12)19-8-7-17-6-2-3-11(10-17)14(16)18;/h1-6,9-10H,7-8H2,(H-,16,18);1H