1-methyl-1-[(Z)-oct-2-en-3-yl]piperazin-1-ium iodide

Systemtic Name: 1-methyl-1-[(Z)-oct-2-en-3-yl]piperazin-1-ium iodide Openeye Name: 1-[(1Z)-1-ethylidenehexyl]-1-methyl-piperazin-1-ium iodide CAS Name: 1-methyl-1-[(Z)-oct-2-en-3-yl]piperazin-1-ium iodide IUPAC Name: 1-methyl-1-[(Z)-oct-2-en-3-yl]piperazin-1-ium iodide Traditional Name: 1-[(Z)-1-amylprop-1-enyl]-1-methyl-piperazin-1-ium iodide Formula: C13H27IN2 MolecularWeight: 338.27135

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC)[N+]1(CCNCC1)C.[I-]

Isomeric SMILES

CCCCC/C(=C/C)/[N+]1(CCNCC1)C.[I-]

InChI

InChI=1S/C13H27N2.HI/c1-4-6-7-8-13(5-2)15(3)11-9-14-10-12-15;/h5,14H,4,6-12H2,1-3H3;1H/q+1;/p-1/b13-5-;