1-(6-chloranyl-5-methoxy-pyridin-3-yl)-N-methyl-azepan-1-ium-1-amine

Systemtic Name: 1-(6-chloranyl-5-methoxy-pyridin-3-yl)-N-methyl-azepan-1-ium-1-amine Openeye Name: 1-(6-chloro-5-methoxy-3-pyridyl)-N-methyl-azepan-1-ium-1-amine CAS Name: 1-(6-chloro-5-methoxy-3-pyridinyl)-N-methyl-1-azepan-1-iumamine IUPAC Name: 1-(6-chloro-5-methoxypyridin-3-yl)-N-methylazepan-1-ium-1-amine Traditional Name: [1-(6-chloro-5-methoxy-3-pyridyl)azepan-1-ium-1-yl]-methyl-amine Formula: C13H21ClN3O+ MolecularWeight: 270.77834

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Descriptors Computed from Structure

Canonical SMILES:

CN[N+]1(CCCCCC1)C2=CC(=C(N=C2)Cl)OC

Isomeric SMILES

CN[N+]1(CCCCCC1)C2=CC(=C(N=C2)Cl)OC

InChI

InChI=1S/C13H21ClN3O/c1-15-17(7-5-3-4-6-8-17)11-9-12(18-2)13(14)16-10-11/h9-10,15H,3-8H2,1-2H3/q+1