5-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)sulfamoyl]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)sulfamoyl]-2-fluoranyl-benzoic acid Openeye Name: 5-[(4,5-dimethoxy-2-methoxycarbonyl-phenyl)sulfamoyl]-2-fluoro-benzoic acid CAS Name: 5-[(4,5-dimethoxy-2-methoxycarbonylphenyl)sulfamoyl]-2-fluorobenzoic acid IUPAC Name: 5-[(4,5-dimethoxy-2-methoxycarbonylphenyl)sulfamoyl]-2-fluorobenzoic acid Traditional Name: 5-[(2-carbomethoxy-4,5-dimethoxy-phenyl)sulfamoyl]-2-fluoro-benzoic acid Formula: C17H16FNO8S MolecularWeight: 413.374243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O)OC

InChI

InChI=1S/C17H16FNO8S/c1-25-14-7-11(17(22)27-3)13(8-15(14)26-2)19-28(23,24)9-4-5-12(18)10(6-9)16(20)21/h4-8,19H,1-3H3,(H,20,21)