[5-(dimethylsulfamoyl)-2-methyl-quinolin-8-yl] 4-bromanylbenzenesulfonate

Systemtic Name: [5-(dimethylsulfamoyl)-2-methyl-quinolin-8-yl] 4-bromanylbenzenesulfonate Openeye Name: [5-(dimethylsulfamoyl)-2-methyl-8-quinolyl] 4-bromobenzenesulfonate CAS Name: 4-bromobenzenesulfonic acid [5-(dimethylsulfamoyl)-2-methyl-8-quinolinyl] ester IUPAC Name: [5-(dimethylsulfamoyl)-2-methylquinolin-8-yl] 4-bromobenzenesulfonate Traditional Name: 4-bromobenzenesulfonic acid [5-(dimethylsulfamoyl)-2-methyl-8-quinolyl] ester Formula: C18H17BrN2O5S2 MolecularWeight: 485.37198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2C=C1)S(=O)(=O)N(C)C)OS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=NC2=C(C=CC(=C2C=C1)S(=O)(=O)N(C)C)OS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O5S2/c1-12-4-9-15-17(27(22,23)21(2)3)11-10-16(18(15)20-12)26-28(24,25)14-7-5-13(19)6-8-14/h4-11H,1-3H3