2-oxidanylidene-2-[5-oxidanyl-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanoic acid

Systemtic Name: 2-oxidanylidene-2-[5-oxidanyl-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanoic acid Openeye Name: 2-[5-hydroxy-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-oxo-acetic acid CAS Name: 2-[5-hydroxy-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-oxoacetic acid IUPAC Name: 2-[5-hydroxy-3-propyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-oxoacetic acid Traditional Name: 2-[5-hydroxy-3-propyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-keto-acetic acid Formula: C9H11F3N2O4 MolecularWeight: 268.18985

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(=O)O

Isomeric SMILES

CCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(=O)O

InChI

InChI=1S/C9H11F3N2O4/c1-2-3-5-4-8(18,9(10,11)12)14(13-5)6(15)7(16)17/h18H,2-4H2,1H3,(H,16,17)