1-(5-bromanylpyridin-1-ium-2-yl)-4-methyl-piperazin-4-ium

Systemtic Name: 1-(5-bromanylpyridin-1-ium-2-yl)-4-methyl-piperazin-4-ium Openeye Name: 1-(5-bromopyridin-1-ium-2-yl)-4-methyl-piperazin-4-ium CAS Name: 1-(5-bromo-2-pyridin-1-iumyl)-4-methylpiperazin-4-ium IUPAC Name: 1-(5-bromopyridin-1-ium-2-yl)-4-methylpiperazin-4-ium Traditional Name: 1-(5-bromopyridin-1-ium-2-yl)-4-methyl-piperazin-4-ium Formula: C10H16BrN3+2 MolecularWeight: 258.15814

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=[NH+]C=C(C=C2)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C2=[NH+]C=C(C=C2)Br

InChI

InChI=1S/C10H14BrN3/c1-13-4-6-14(7-5-13)10-3-2-9(11)8-12-10/h2-3,8H,4-7H2,1H3/p+2