5-bromanyl-2-piperazin-4-ium-1-yl-pyrimidine chloride

Systemtic Name: 5-bromanyl-2-piperazin-4-ium-1-yl-pyrimidine chloride Openeye Name: 5-bromo-2-piperazin-4-ium-1-yl-pyrimidine chloride CAS Name: 5-bromo-2-(1-piperazin-4-iumyl)pyrimidine chloride IUPAC Name: 5-bromo-2-piperazin-4-ium-1-ylpyrimidine chloride Traditional Name: 5-bromo-2-piperazin-4-ium-1-yl-pyrimidine chloride Formula: C8H12BrClN4 MolecularWeight: 279.56468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC=C(C=N2)Br.[Cl-]

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC=C(C=N2)Br.[Cl-]

InChI

InChI=1S/C8H11BrN4.ClH/c9-7-5-11-8(12-6-7)13-3-1-10-2-4-13;/h5-6,10H,1-4H2;1H