[3-(4-methylphenyl)sulfonyloxyquinoxalin-2-yl] 4-methylbenzenesulfonate

Systemtic Name: [3-(4-methylphenyl)sulfonyloxyquinoxalin-2-yl] 4-methylbenzenesulfonate Openeye Name: [3-(p-tolylsulfonyloxy)quinoxalin-2-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(4-methylphenyl)sulfonyloxy-2-quinoxalinyl] ester IUPAC Name: [3-(4-methylphenyl)sulfonyloxyquinoxalin-2-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-tosyloxyquinoxalin-2-yl) ester Formula: C22H18N2O6S2 MolecularWeight: 470.51812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=NC3=CC=CC=C3N=C2OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=NC3=CC=CC=C3N=C2OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H18N2O6S2/c1-15-7-11-17(12-8-15)31(25,26)29-21-22(24-20-6-4-3-5-19(20)23-21)30-32(27,28)18-13-9-16(2)10-14-18/h3-14H,1-2H3