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

Systemtic Name: 2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]acetic acid CAS Name: 2-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]acetic acid Traditional Name: 2-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]acetic acid Formula: C13H15F3N2O4S MolecularWeight: 352.32941

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC(=O)O)S(=O)(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H15F3N2O4S/c14-13(15,16)10-1-3-11(4-2-10)23(21,22)18-7-5-17(6-8-18)9-12(19)20/h1-4H,5-9H2,(H,19,20)