5-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]sulfamoyl]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]sulfamoyl]-2-fluoranyl-benzoic acid Openeye Name: 5-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]sulfamoyl]-2-fluoro-benzoic acid CAS Name: 5-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]sulfamoyl]-2-fluorobenzoic acid IUPAC Name: 5-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]sulfamoyl]-2-fluorobenzoic acid Traditional Name: 5-[[4-[cyclohexyl(methyl)sulfamoyl]phenyl]sulfamoyl]-2-fluoro-benzoic acid Formula: C20H23FN2O6S2 MolecularWeight: 470.534823

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)C(=O)O

InChI

InChI=1S/C20H23FN2O6S2/c1-23(15-5-3-2-4-6-15)31(28,29)16-9-7-14(8-10-16)22-30(26,27)17-11-12-19(21)18(13-17)20(24)25/h7-13,15,22H,2-6H2,1H3,(H,24,25)