5-chloranyl-1-methyl-pyridin-1-ium-2-amine; methanesulfonate

Systemtic Name: 5-chloranyl-1-methyl-pyridin-1-ium-2-amine; methanesulfonate Openeye Name: 5-chloro-1-methyl-pyridin-1-ium-2-amine; methanesulfonate CAS Name: 5-chloro-1-methyl-2-pyridin-1-iumamine; methanesulfonate IUPAC Name: 5-chloro-1-methylpyridin-1-ium-2-amine; methanesulfonate Traditional Name: (5-chloro-1-methyl-pyridin-1-ium-2-yl)amine mesylate Formula: C7H11ClN2O3S MolecularWeight: 238.69184

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC(=C1)Cl)N.CS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=C(C=CC(=C1)Cl)N.CS(=O)(=O)[O-]

InChI

InChI=1S/C6H7ClN2.CH4O3S/c1-9-4-5(7)2-3-6(9)8;1-5(2,3)4/h2-4,8H,1H3;1H3,(H,2,3,4)