1-(6-bromanylpyridin-3-yl)-N-methyl-azepan-1-ium-1-amine

Systemtic Name: 1-(6-bromanylpyridin-3-yl)-N-methyl-azepan-1-ium-1-amine Openeye Name: 1-(6-bromo-3-pyridyl)-N-methyl-azepan-1-ium-1-amine CAS Name: 1-(6-bromo-3-pyridinyl)-N-methyl-1-azepan-1-iumamine IUPAC Name: 1-(6-bromopyridin-3-yl)-N-methylazepan-1-ium-1-amine Traditional Name: [1-(6-bromo-3-pyridyl)azepan-1-ium-1-yl]-methyl-amine Formula: C12H19BrN3+ MolecularWeight: 285.20336

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Descriptors Computed from Structure

Canonical SMILES:

CN[N+]1(CCCCCC1)C2=CN=C(C=C2)Br

Isomeric SMILES

CN[N+]1(CCCCCC1)C2=CN=C(C=C2)Br

InChI

InChI=1S/C12H19BrN3/c1-14-16(8-4-2-3-5-9-16)11-6-7-12(13)15-10-11/h6-7,10,14H,2-5,8-9H2,1H3/q+1