benzenesulfonate; 1-butyl-3-methyl-imidazol-3-ium

Systemtic Name: benzenesulfonate; 1-butyl-3-methyl-imidazol-3-ium Openeye Name: benzenesulfonate; 1-butyl-3-methyl-imidazol-3-ium CAS Name: benzenesulfonate; 1-butyl-3-methylimidazol-3-ium IUPAC Name: benzenesulfonate; 1-butyl-3-methylimidazol-3-ium Traditional Name: 1-butyl-3-methyl-imidazol-3-ium besylate Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15N2.C6H6O3S/c1-3-4-5-10-7-6-9(2)8-10;7-10(8,9)6-4-2-1-3-5-6/h6-8H,3-5H2,1-2H3;1-5H,(H,7,8,9)/q+1;/p-1