(2R)-2-(4-fluorophenyl)-2-piperazin-1-ium-1-yl-ethanoate

Systemtic Name: (2R)-2-(4-fluorophenyl)-2-piperazin-1-ium-1-yl-ethanoate Openeye Name: (2R)-2-(4-fluorophenyl)-2-piperazin-1-ium-1-yl-acetate CAS Name: (2R)-2-(4-fluorophenyl)-2-(1-piperazin-1-iumyl)acetate IUPAC Name: (2R)-2-(4-fluorophenyl)-2-piperazin-1-ium-1-ylacetate Traditional Name: (2R)-2-(4-fluorophenyl)-2-piperazin-1-ium-1-yl-acetate Formula: C12H15FN2O2 MolecularWeight: 238.258103

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN1)C(C2=CC=C(C=C2)F)C(=O)[O-]

Isomeric SMILES

C1C[NH+](CCN1)[C@H](C2=CC=C(C=C2)F)C(=O)[O-]

InChI

InChI=1S/C12H15FN2O2/c13-10-3-1-9(2-4-10)11(12(16)17)15-7-5-14-6-8-15/h1-4,11,14H,5-8H2,(H,16,17)/t11-/m1/s1