1-butyl-1-propyl-azepan-1-ium iodide

Systemtic Name: 1-butyl-1-propyl-azepan-1-ium iodide Openeye Name: 1-butyl-1-propyl-azepan-1-ium iodide CAS Name: 1-butyl-1-propylazepan-1-ium iodide IUPAC Name: 1-butyl-1-propylazepan-1-ium iodide Traditional Name: 1-butyl-1-propyl-azepan-1-ium iodide Formula: C13H28IN MolecularWeight: 325.27259

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CCCCCC1)CCC.[I-]

Isomeric SMILES

CCCC[N+]1(CCCCCC1)CCC.[I-]

InChI

InChI=1S/C13H28N.HI/c1-3-5-11-14(10-4-2)12-8-6-7-9-13-14;/h3-13H2,1-2H3;1H/q+1;/p-1