6-[[2-(dimethylsulfamoyl)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-[[2-(dimethylsulfamoyl)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-[[2-(dimethylsulfamoyl)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-[[2-(dimethylsulfamoyl)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-[[2-(dimethylsulfamoyl)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-[2-(dimethylsulfamoyl)benzyl]-1-(2-hydroxyethyl)-4-keto-quinoline-3-carboxylic acid Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC=C1CC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)O)CCO

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC=C1CC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)O)CCO

InChI

InChI=1S/C21H22N2O6S/c1-22(2)30(28,29)19-6-4-3-5-15(19)11-14-7-8-18-16(12-14)20(25)17(21(26)27)13-23(18)9-10-24/h3-8,12-13,24H,9-11H2,1-2H3,(H,26,27)