(3-quinoxalin-2-ylphenyl) 4-bromanyl-3-(diethylsulfamoyl)benzoate

Systemtic Name: (3-quinoxalin-2-ylphenyl) 4-bromanyl-3-(diethylsulfamoyl)benzoate Openeye Name: (3-quinoxalin-2-ylphenyl) 4-bromo-3-(diethylsulfamoyl)benzoate CAS Name: 4-bromo-3-(diethylsulfamoyl)benzoic acid [3-(2-quinoxalinyl)phenyl] ester IUPAC Name: (3-quinoxalin-2-ylphenyl) 4-bromo-3-(diethylsulfamoyl)benzoate Traditional Name: 4-bromo-3-(diethylsulfamoyl)benzoic acid (3-quinoxalin-2-ylphenyl) ester Formula: C25H22BrN3O4S MolecularWeight: 540.42888

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OC2=CC=CC(=C2)C3=NC4=CC=CC=C4N=C3)Br

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OC2=CC=CC(=C2)C3=NC4=CC=CC=C4N=C3)Br

InChI

InChI=1S/C25H22BrN3O4S/c1-3-29(4-2)34(31,32)24-15-18(12-13-20(24)26)25(30)33-19-9-7-8-17(14-19)23-16-27-21-10-5-6-11-22(21)28-23/h5-16H,3-4H2,1-2H3