4-(2-bromoethyl)-1,1-dimethyl-piperazin-1-ium iodide

Systemtic Name: 4-(2-bromoethyl)-1,1-dimethyl-piperazin-1-ium iodide Openeye Name: 4-(2-bromoethyl)-1,1-dimethyl-piperazin-1-ium iodide CAS Name: 4-(2-bromoethyl)-1,1-dimethylpiperazin-1-ium iodide IUPAC Name: 4-(2-bromoethyl)-1,1-dimethylpiperazin-1-ium iodide Traditional Name: 4-(2-bromoethyl)-1,1-dimethyl-piperazin-1-ium iodide Formula: C8H18BrIN2 MolecularWeight: 349.05039

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)CCBr)C.[I-]

Isomeric SMILES

C[N+]1(CCN(CC1)CCBr)C.[I-]

InChI

InChI=1S/C8H18BrN2.HI/c1-11(2)7-5-10(4-3-9)6-8-11;/h3-8H2,1-2H3;1H/q+1;/p-1