2,2-dimethyl-5-oxidanyl-pyrazolidin-2-ium-1-carbaldehyde; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: 2,2-dimethyl-5-oxidanyl-pyrazolidin-2-ium-1-carbaldehyde; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: 5-hydroxy-2,2-dimethyl-pyrazolidin-2-ium-1-carbaldehyde; 2,2,2-trifluoroacetate CAS Name: 5-hydroxy-2,2-dimethyl-1-pyrazolidin-2-iumcarboxaldehyde; 2,2,2-trifluoroacetate IUPAC Name: 5-hydroxy-2,2-dimethylpyrazolidin-2-ium-1-carbaldehyde; 2,2,2-trifluoroacetate Traditional Name: 5-hydroxy-2,2-dimethyl-pyrazolidin-2-ium-1-carbaldehyde; 2,2,2-trifluoroacetate Formula: C8H13F3N2O4 MolecularWeight: 258.19503

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(N1C=O)O)C.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

C[N+]1(CCC(N1C=O)O)C.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C6H13N2O2.C2HF3O2/c1-8(2)4-3-6(10)7(8)5-9;3-2(4,5)1(6)7/h5-6,10H,3-4H2,1-2H3;(H,6,7)/q+1;/p-1