[(2S)-1-(3-octylimidazol-1-ium-1-yl)propan-2-yl] hydrogen sulfate

Systemtic Name: [(2S)-1-(3-octylimidazol-1-ium-1-yl)propan-2-yl] hydrogen sulfate Openeye Name: [(1S)-1-methyl-2-(3-octylimidazol-1-ium-1-yl)ethyl] hydrogen sulfate CAS Name: sulfuric acid [(2S)-1-(3-octyl-1-imidazol-1-iumyl)propan-2-yl] ester IUPAC Name: [(2S)-1-(3-octylimidazol-1-ium-1-yl)propan-2-yl] hydrogen sulfate Traditional Name: sulfuric acid [(1S)-1-methyl-2-(3-octylimidazol-1-ium-1-yl)ethyl] ester Formula: C14H27N2O4S+ MolecularWeight: 319.44018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=C[N+](=C1)CC(C)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCN1C=C[N+](=C1)C[C@H](C)OS(=O)(=O)O

InChI

InChI=1S/C14H26N2O4S/c1-3-4-5-6-7-8-9-15-10-11-16(13-15)12-14(2)20-21(17,18)19/h10-11,13-14H,3-9,12H2,1-2H3/p+1/t14-/m0/s1