(3S,4R)-3-ethyl-4-[(3-methyl-1-octyl-imidazol-1-ium-4-yl)methyl]oxolan-2-one iodide

Systemtic Name: (3S,4R)-3-ethyl-4-[(3-methyl-1-octyl-imidazol-1-ium-4-yl)methyl]oxolan-2-one iodide Openeye Name: (3S,4R)-3-ethyl-4-[(3-methyl-1-octyl-imidazol-1-ium-4-yl)methyl]tetrahydrofuran-2-one iodide CAS Name: (3S,4R)-3-ethyl-4-[(3-methyl-1-octyl-4-imidazol-1-iumyl)methyl]-2-oxolanone iodide IUPAC Name: (3S,4R)-3-ethyl-4-[(3-methyl-1-octylimidazol-1-ium-4-yl)methyl]oxolan-2-one iodide Traditional Name: (3S,4R)-3-ethyl-4-[(3-methyl-1-octyl-imidazol-1-ium-4-yl)methyl]tetrahydrofuran-2-one iodide Formula: C19H33IN2O2 MolecularWeight: 448.38199

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1=CN(C(=C1)CC2COC(=O)C2CC)C.[I-]

Isomeric SMILES

CCCCCCCC[N+]1=CN(C(=C1)C[C@H]2COC(=O)[C@H]2CC)C.[I-]

InChI

InChI=1S/C19H33N2O2.HI/c1-4-6-7-8-9-10-11-21-13-17(20(3)15-21)12-16-14-23-19(22)18(16)5-2;/h13,15-16,18H,4-12,14H2,1-3H3;1H/q+1;/p-1/t16-,18-;/m0./s1