2-oxidanyl-5-[(E)-3-[4-(pyridin-2-ylsulfamoyl)phenyl]prop-2-enoyl]benzoic acid

Systemtic Name: 2-oxidanyl-5-[(E)-3-[4-(pyridin-2-ylsulfamoyl)phenyl]prop-2-enoyl]benzoic acid Openeye Name: 2-hydroxy-5-[(E)-3-[4-(2-pyridylsulfamoyl)phenyl]prop-2-enoyl]benzoic acid CAS Name: 2-hydroxy-5-[(E)-1-oxo-3-[4-(2-pyridinylsulfamoyl)phenyl]prop-2-enyl]benzoic acid IUPAC Name: 2-hydroxy-5-[(E)-3-[4-(pyridin-2-ylsulfamoyl)phenyl]prop-2-enoyl]benzoic acid Traditional Name: 2-hydroxy-5-[(E)-3-[4-(2-pyridylsulfamoyl)phenyl]acryloyl]benzoic acid Formula: C21H16N2O6S MolecularWeight: 424.42654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)C3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)C3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C21H16N2O6S/c24-18(15-7-11-19(25)17(13-15)21(26)27)10-6-14-4-8-16(9-5-14)30(28,29)23-20-3-1-2-12-22-20/h1-13,25H,(H,22,23)(H,26,27)/b10-6+