2-[1-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-pyridin-1-ium-3-yl]ethanol bromide hydrobromide

Systemtic Name: 2-[1-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-pyridin-1-ium-3-yl]ethanol bromide hydrobromide Openeye Name: 2-[1-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-pyridin-1-ium-3-yl]ethanol bromide hydrobromide CAS Name: 2-[1-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-2-methyl-3-pyridin-1-iumyl]ethanol bromide hydrobromide IUPAC Name: 2-[1-[(4-amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethanol bromide hydrobromide Traditional Name: 2-[1-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-2-methyl-pyridin-1-ium-3-yl]ethanol bromide hydrobromide Formula: C14H20Br2N4O MolecularWeight: 420.1428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=[N+]1CC2=CN=C(N=C2N)C)CCO.Br.[Br-]

Isomeric SMILES

CC1=C(C=CC=[N+]1CC2=CN=C(N=C2N)C)CCO.Br.[Br-]

InChI

InChI=1S/C14H19N4O.2BrH/c1-10-12(5-7-19)4-3-6-18(10)9-13-8-16-11(2)17-14(13)15;;/h3-4,6,8,19H,5,7,9H2,1-2H3,(H2,15,16,17);2*1H/q+1;;/p-1