1,4-dimethylimidazo[4,5-b]quinoxalin-4-ium; 4-methylbenzenesulfonate

Systemtic Name: 1,4-dimethylimidazo[4,5-b]quinoxalin-4-ium; 4-methylbenzenesulfonate Openeye Name: 1,4-dimethylimidazo[4,5-b]quinoxalin-4-ium; 4-methylbenzenesulfonate CAS Name: 1,4-dimethylimidazo[4,5-b]quinoxalin-4-ium; 4-methylbenzenesulfonate IUPAC Name: 1,4-dimethylimidazo[4,5-b]quinoxalin-4-ium; 4-methylbenzenesulfonate Traditional Name: 1,4-dimethylimidazo[4,5-b]quinoxalin-4-ium tosylate Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C=NC2=[N+](C3=CC=CC=C3N=C21)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CN1C=NC2=[N+](C3=CC=CC=C3N=C21)C

InChI

InChI=1S/C11H11N4.C7H8O3S/c1-14-7-12-10-11(14)13-8-5-3-4-6-9(8)15(10)2;1-6-2-4-7(5-3-6)11(8,9)10/h3-7H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1