2-[2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-4-(trifluoromethyl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-4-(trifluoromethyl)phenoxy]ethanoic acid Openeye Name: 2-[2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-4-(trifluoromethyl)phenoxy]acetic acid CAS Name: 2-[2-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-4-(trifluoromethyl)phenoxy]acetic acid IUPAC Name: 2-[2-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-4-(trifluoromethyl)phenoxy]acetic acid Traditional Name: 2-[2-[4-(4-fluorophenyl)sulfonylpiperazino]-4-(trifluoromethyl)phenoxy]acetic acid Formula: C19H18F4N2O5S MolecularWeight: 462.415233

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18F4N2O5S/c20-14-2-4-15(5-3-14)31(28,29)25-9-7-24(8-10-25)16-11-13(19(21,22)23)1-6-17(16)30-12-18(26)27/h1-6,11H,7-10,12H2,(H,26,27)