1-(3-fluorophenyl)-4-methyl-piperazin-4-ium; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 1-(3-fluorophenyl)-4-methyl-piperazin-4-ium; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 1-(3-fluorophenyl)-4-methyl-piperazin-4-ium; 2-hydroxy-2-oxo-acetate CAS Name: 1-(3-fluorophenyl)-4-methylpiperazin-4-ium; 2-hydroxy-2-oxoacetate IUPAC Name: 1-(3-fluorophenyl)-4-methylpiperazin-4-ium; 2-hydroxy-2-oxoacetate Traditional Name: 1-(3-fluorophenyl)-4-methyl-piperazin-4-ium binoxalate Formula: C13H17FN2O4 MolecularWeight: 284.283483

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC(=CC=C2)F.C(=O)(C(=O)[O-])O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC(=CC=C2)F.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C11H15FN2.C2H2O4/c1-13-5-7-14(8-6-13)11-4-2-3-10(12)9-11;3-1(4)2(5)6/h2-4,9H,5-8H2,1H3;(H,3,4)(H,5,6)