1-(6-bromanyl-5-ethoxy-pyridin-3-yl)-N-methyl-azepan-1-ium-1-amine

Systemtic Name: 1-(6-bromanyl-5-ethoxy-pyridin-3-yl)-N-methyl-azepan-1-ium-1-amine Openeye Name: 1-(6-bromo-5-ethoxy-3-pyridyl)-N-methyl-azepan-1-ium-1-amine CAS Name: 1-(6-bromo-5-ethoxy-3-pyridinyl)-N-methyl-1-azepan-1-iumamine IUPAC Name: 1-(6-bromo-5-ethoxypyridin-3-yl)-N-methylazepan-1-ium-1-amine Traditional Name: [1-(6-bromo-5-ethoxy-3-pyridyl)azepan-1-ium-1-yl]-methyl-amine Formula: C14H23BrN3O+ MolecularWeight: 329.25592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=CC(=C1)[N+]2(CCCCCC2)NC)Br

Isomeric SMILES

CCOC1=C(N=CC(=C1)[N+]2(CCCCCC2)NC)Br

InChI

InChI=1S/C14H23BrN3O/c1-3-19-13-10-12(11-17-14(13)15)18(16-2)8-6-4-5-7-9-18/h10-11,16H,3-9H2,1-2H3/q+1