4-[2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylethylsulfamoyl]benzoic acid

Systemtic Name: 4-[2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylethylsulfamoyl]benzoic acid Openeye Name: 4-[2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylethylsulfamoyl]benzoic acid CAS Name: 4-[2-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]ethylsulfamoyl]benzoic acid IUPAC Name: 4-[2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylethylsulfamoyl]benzoic acid Traditional Name: 4-[2-[4-(4-fluorophenyl)piperazino]sulfonylethylsulfamoyl]benzoic acid Formula: C19H22FN3O6S2 MolecularWeight: 471.522883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)CCNS(=O)(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)S(=O)(=O)CCNS(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H22FN3O6S2/c20-16-3-5-17(6-4-16)22-10-12-23(13-11-22)30(26,27)14-9-21-31(28,29)18-7-1-15(2-8-18)19(24)25/h1-8,21H,9-14H2,(H,24,25)