1-butyl-3-methyl-4,5-dihydroimidazol-3-ium; methyl sulfate

Systemtic Name: 1-butyl-3-methyl-4,5-dihydroimidazol-3-ium; methyl sulfate Openeye Name: 1-butyl-3-methyl-4,5-dihydroimidazol-3-ium; methyl sulfate CAS Name: 1-butyl-3-methyl-4,5-dihydroimidazol-3-ium; methyl sulfate IUPAC Name: 1-butyl-3-methyl-4,5-dihydroimidazol-3-ium; methyl sulfate Traditional Name: 1-butyl-3-methyl-2-imidazolin-3-ium; methyl sulfate Formula: C9H20N2O4S MolecularWeight: 252.3311

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC[N+](=C1)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCN1CC[N+](=C1)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C8H17N2.CH4O4S/c1-3-4-5-10-7-6-9(2)8-10;1-5-6(2,3)4/h8H,3-7H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1