2-[5,7-bis(chloranyl)-1-benzofuran-2-yl]-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid

Systemtic Name: 2-[5,7-bis(chloranyl)-1-benzofuran-2-yl]-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid Openeye Name: 2-(5,7-dichlorobenzofuran-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid CAS Name: 2-(5,7-dichloro-2-benzofuranyl)-6-(dimethylsulfamoyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(5,7-dichloro-1-benzofuran-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid Traditional Name: 2-(5,7-dichlorobenzofuran-2-yl)-6-(dimethylsulfamoyl)cinchoninic acid Formula: C20H14Cl2N2O5S MolecularWeight: 465.30656

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC4=CC(=CC(=C4O3)Cl)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC4=CC(=CC(=C4O3)Cl)Cl

InChI

InChI=1S/C20H14Cl2N2O5S/c1-24(2)30(27,28)12-3-4-16-13(8-12)14(20(25)26)9-17(23-16)18-6-10-5-11(21)7-15(22)19(10)29-18/h3-9H,1-2H3,(H,25,26)