4-[furan-2-ylcarbonyl-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)sulfamoyl]benzoic acid

Systemtic Name: 4-[furan-2-ylcarbonyl-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)sulfamoyl]benzoic acid Openeye Name: 4-[furan-2-carbonyl-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)sulfamoyl]benzoic acid CAS Name: 4-[[2-furanyl(oxo)methyl]-(2-oxo-5-benzo[g][1,3]benzoxathiolyl)sulfamoyl]benzoic acid IUPAC Name: 4-[furan-2-carbonyl-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)sulfamoyl]benzoic acid Traditional Name: 4-[2-furoyl-(2-ketobenzo[g][1,3]benzoxathiol-5-yl)sulfamoyl]benzoic acid Formula: C23H13NO8S2 MolecularWeight: 495.48122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC3=C2OC(=O)S3)N(C(=O)C4=CC=CO4)S(=O)(=O)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC3=C2OC(=O)S3)N(C(=O)C4=CC=CO4)S(=O)(=O)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C23H13NO8S2/c25-21(18-6-3-11-31-18)24(34(29,30)14-9-7-13(8-10-14)22(26)27)17-12-19-20(32-23(28)33-19)16-5-2-1-4-15(16)17/h1-12H,(H,26,27)