5-[2-[4-[(5-chloranylpyridin-2-yl)sulfamoyl]phenyl]ethynyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-[4-[(5-chloranylpyridin-2-yl)sulfamoyl]phenyl]ethynyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[2-[4-[(5-chloro-2-pyridyl)sulfamoyl]phenyl]ethynyl]-2-hydroxy-benzoic acid CAS Name: 5-[2-[4-[(5-chloro-2-pyridinyl)sulfamoyl]phenyl]ethynyl]-2-hydroxybenzoic acid IUPAC Name: 5-[2-[4-[(5-chloropyridin-2-yl)sulfamoyl]phenyl]ethynyl]-2-hydroxybenzoic acid Traditional Name: 5-[2-[4-[(5-chloro-2-pyridyl)sulfamoyl]phenyl]ethynyl]-2-hydroxy-benzoic acid Formula: C20H13ClN2O5S MolecularWeight: 428.84562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC2=CC(=C(C=C2)O)C(=O)O)S(=O)(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1C#CC2=CC(=C(C=C2)O)C(=O)O)S(=O)(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C20H13ClN2O5S/c21-15-6-10-19(22-12-15)23-29(27,28)16-7-3-13(4-8-16)1-2-14-5-9-18(24)17(11-14)20(25)26/h3-12,24H,(H,22,23)(H,25,26)