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

Systemtic Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylbenzoic acid Openeye Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylbenzoic acid CAS Name: 4-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]benzoic acid IUPAC Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylbenzoic acid Traditional Name: 4-[4-(2-fluorophenyl)piperazino]sulfonylbenzoic acid Formula: C17H17FN2O4S MolecularWeight: 364.391283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)S(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

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