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

Systemtic Name: (3S,4R)-3-ethyl-4-[(1-hexyl-3-methyl-imidazol-1-ium-4-yl)methyl]oxolan-2-one chloride Openeye Name: (3S,4R)-3-ethyl-4-[(1-hexyl-3-methyl-imidazol-1-ium-4-yl)methyl]tetrahydrofuran-2-one chloride CAS Name: (3S,4R)-3-ethyl-4-[(1-hexyl-3-methyl-4-imidazol-1-iumyl)methyl]-2-oxolanone chloride IUPAC Name: (3S,4R)-3-ethyl-4-[(1-hexyl-3-methylimidazol-1-ium-4-yl)methyl]oxolan-2-one chloride Traditional Name: (3S,4R)-3-ethyl-4-[(1-hexyl-3-methyl-imidazol-1-ium-4-yl)methyl]tetrahydrofuran-2-one chloride Formula: C17H29ClN2O2 MolecularWeight: 328.87736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29N2O2.ClH/c1-4-6-7-8-9-19-11-15(18(3)13-19)10-14-12-21-17(20)16(14)5-2;/h11,13-14,16H,4-10,12H2,1-3H3;1H/q+1;/p-1/t14-,16-;/m0./s1