6-chloranyl-4-[[4-(pyridin-2-ylsulfamoyl)phenyl]amino]quinoline-3-carboxylic acid hydrochloride

Systemtic Name: 6-chloranyl-4-[[4-(pyridin-2-ylsulfamoyl)phenyl]amino]quinoline-3-carboxylic acid hydrochloride Openeye Name: 6-chloro-4-[4-(2-pyridylsulfamoyl)anilino]quinoline-3-carboxylic acid hydrochloride CAS Name: 6-chloro-4-[4-(2-pyridinylsulfamoyl)anilino]-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 6-chloro-4-[4-(pyridin-2-ylsulfamoyl)anilino]quinoline-3-carboxylic acid hydrochloride Traditional Name: 6-chloro-4-[4-(2-pyridylsulfamoyl)anilino]quinoline-3-carboxylic acid hydrochloride Formula: C21H16Cl2N4O4S MolecularWeight: 491.34714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=C4C=C(C=CC4=NC=C3C(=O)O)Cl.Cl

Isomeric SMILES

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=C4C=C(C=CC4=NC=C3C(=O)O)Cl.Cl

InChI

InChI=1S/C21H15ClN4O4S.ClH/c22-13-4-9-18-16(11-13)20(17(12-24-18)21(27)28)25-14-5-7-15(8-6-14)31(29,30)26-19-3-1-2-10-23-19;/h1-12H,(H,23,26)(H,24,25)(H,27,28);1H