2-(5-chloranyl-1-benzofuran-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(5-chloranyl-1-benzofuran-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid Openeye Name: 2-(5-chlorobenzofuran-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid CAS Name: 2-(5-chloro-2-benzofuranyl)-6-(dimethylsulfamoyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(5-chloro-1-benzofuran-2-yl)-6-(dimethylsulfamoyl)quinoline-4-carboxylic acid Traditional Name: 2-(5-chlorobenzofuran-2-yl)-6-(dimethylsulfamoyl)cinchoninic acid Formula: C20H15ClN2O5S MolecularWeight: 430.8615

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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=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C20H15ClN2O5S/c1-23(2)29(26,27)13-4-5-16-14(9-13)15(20(24)25)10-17(22-16)19-8-11-7-12(21)3-6-18(11)28-19/h3-10H,1-2H3,(H,24,25)