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

Systemtic Name: 1-(6-chloranyl-5-methyl-pyridin-3-yl)-N-methyl-azepan-1-ium-1-amine Openeye Name: 1-(6-chloro-5-methyl-3-pyridyl)-N-methyl-azepan-1-ium-1-amine CAS Name: 1-(6-chloro-5-methyl-3-pyridinyl)-N-methyl-1-azepan-1-iumamine IUPAC Name: 1-(6-chloro-5-methylpyridin-3-yl)-N-methylazepan-1-ium-1-amine Traditional Name: [1-(6-chloro-5-methyl-3-pyridyl)azepan-1-ium-1-yl]-methyl-amine Formula: C13H21ClN3+ MolecularWeight: 254.77894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CN=C1Cl)[N+]2(CCCCCC2)NC

Isomeric SMILES

CC1=CC(=CN=C1Cl)[N+]2(CCCCCC2)NC

InChI

InChI=1S/C13H21ClN3/c1-11-9-12(10-16-13(11)14)17(15-2)7-5-3-4-6-8-17/h9-10,15H,3-8H2,1-2H3/q+1