6-[[2,3-bis(chloranyl)-4,6-disulfamoyl-phenyl]carbamoyl]pyridine-2-carboxylic acid

Systemtic Name: 6-[[2,3-bis(chloranyl)-4,6-disulfamoyl-phenyl]carbamoyl]pyridine-2-carboxylic acid Openeye Name: 6-[(2,3-dichloro-4,6-disulfamoyl-phenyl)carbamoyl]pyridine-2-carboxylic acid CAS Name: 6-[(2,3-dichloro-4,6-disulfamoylanilino)-oxomethyl]-2-pyridinecarboxylic acid IUPAC Name: 6-[(2,3-dichloro-4,6-disulfamoylphenyl)carbamoyl]pyridine-2-carboxylic acid Traditional Name: 6-[(2,3-dichloro-4,6-disulfamoyl-phenyl)carbamoyl]picolinic acid Formula: C13H10Cl2N4O7S2 MolecularWeight: 469.2771

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)C(=O)O)C(=O)NC2=C(C(=C(C=C2S(=O)(=O)N)S(=O)(=O)N)Cl)Cl

Isomeric SMILES

C1=CC(=NC(=C1)C(=O)O)C(=O)NC2=C(C(=C(C=C2S(=O)(=O)N)S(=O)(=O)N)Cl)Cl

InChI

InChI=1S/C13H10Cl2N4O7S2/c14-9-7(27(16,23)24)4-8(28(17,25)26)11(10(9)15)19-12(20)5-2-1-3-6(18-5)13(21)22/h1-4H,(H,19,20)(H,21,22)(H2,16,23,24)(H2,17,25,26)