(3-methylimidazol-3-ium-1-yl)-(1,4-oxazepan-4-yl)methanone iodide

Systemtic Name: (3-methylimidazol-3-ium-1-yl)-(1,4-oxazepan-4-yl)methanone iodide Openeye Name: (3-methylimidazol-3-ium-1-yl)-(1,4-oxazepan-4-yl)methanone iodide CAS Name: (3-methyl-1-imidazol-3-iumyl)-(1,4-oxazepan-4-yl)methanone iodide IUPAC Name: (3-methylimidazol-3-ium-1-yl)-(1,4-oxazepan-4-yl)methanone iodide Traditional Name: (3-methylimidazol-3-ium-1-yl)-(1,4-oxazepan-4-yl)methanone iodide Formula: C10H16IN3O2 MolecularWeight: 337.15741

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)C(=O)N2CCCOCC2.[I-]

Isomeric SMILES

C[N+]1=CN(C=C1)C(=O)N2CCCOCC2.[I-]

InChI

InChI=1S/C10H16N3O2.HI/c1-11-4-5-13(9-11)10(14)12-3-2-7-15-8-6-12;/h4-5,9H,2-3,6-8H2,1H3;1H/q+1;/p-1