4-methylbenzenesulfonate; 2-(3-methyl-2-undecyl-4,5-dihydroimidazol-3-ium-1-yl)ethanol

Systemtic Name: 4-methylbenzenesulfonate; 2-(3-methyl-2-undecyl-4,5-dihydroimidazol-3-ium-1-yl)ethanol Openeye Name: 4-methylbenzenesulfonate; 2-(3-methyl-2-undecyl-4,5-dihydroimidazol-3-ium-1-yl)ethanol CAS Name: 4-methylbenzenesulfonate; 2-(3-methyl-2-undecyl-4,5-dihydroimidazol-3-ium-1-yl)ethanol IUPAC Name: 4-methylbenzenesulfonate; 2-(3-methyl-2-undecyl-4,5-dihydroimidazol-3-ium-1-yl)ethanol Traditional Name: 2-(3-methyl-2-undecyl-2-imidazolin-3-ium-1-yl)ethanol tosylate Formula: C24H42N2O4S MolecularWeight: 454.66628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=[N+](CCN1CCO)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC1=[N+](CCN1CCO)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C17H35N2O.C7H8O3S/c1-3-4-5-6-7-8-9-10-11-12-17-18(2)13-14-19(17)15-16-20;1-6-2-4-7(5-3-6)11(8,9)10/h20H,3-16H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1