4-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzoic acid

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzoic acid Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzoic acid CAS Name: 4-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]benzoic acid IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzoic acid Traditional Name: 4-[4-(4-fluorophenyl)piperazino]sulfonylbenzoic acid Formula: C17H17FN2O4S MolecularWeight: 364.391283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17FN2O4S/c18-14-3-5-15(6-4-14)19-9-11-20(12-10-19)25(23,24)16-7-1-13(2-8-16)17(21)22/h1-8H,9-12H2,(H,21,22)