1-ethyl-3-methyl-imidazol-3-ium; octyl sulfate

Systemtic Name: 1-ethyl-3-methyl-imidazol-3-ium; octyl sulfate Openeye Name: 1-ethyl-3-methyl-imidazol-3-ium; octyl sulfate CAS Name: 1-ethyl-3-methylimidazol-3-ium; octyl sulfate IUPAC Name: 1-ethyl-3-methylimidazol-3-ium; octyl sulfate Traditional Name: 1-ethyl-3-methyl-imidazol-3-ium; octyl sulfate Formula: C14H28N2O4S MolecularWeight: 320.44812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOS(=O)(=O)[O-].CCN1C=C[N+](=C1)C

Isomeric SMILES

CCCCCCCCOS(=O)(=O)[O-].CCN1C=C[N+](=C1)C

InChI

InChI=1S/C8H18O4S.C6H11N2/c1-2-3-4-5-6-7-8-12-13(9,10)11;1-3-8-5-4-7(2)6-8/h2-8H2,1H3,(H,9,10,11);4-6H,3H2,1-2H3/q;+1/p-1