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

Systemtic Name: 1-butyl-3-methyl-imidazol-3-ium; octyl sulfate Openeye Name: 1-butyl-3-methyl-imidazol-3-ium; octyl sulfate CAS Name: 1-butyl-3-methylimidazol-3-ium; octyl sulfate IUPAC Name: 1-butyl-3-methylimidazol-3-ium; octyl sulfate Traditional Name: 1-butyl-3-methyl-imidazol-3-ium; octyl sulfate Formula: C16H32N2O4S MolecularWeight: 348.50128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOS(=O)(=O)[O-].CCCCN1C=C[N+](=C1)C

Isomeric SMILES

CCCCCCCCOS(=O)(=O)[O-].CCCCN1C=C[N+](=C1)C

InChI

InChI=1S/C8H15N2.C8H18O4S/c1-3-4-5-10-7-6-9(2)8-10;1-2-3-4-5-6-7-8-12-13(9,10)11/h6-8H,3-5H2,1-2H3;2-8H2,1H3,(H,9,10,11)/q+1;/p-1