5-chloranyl-1-pyrimidin-2-yl-3-(trifluoromethyl)pyrazole-4-carboxylic acid

Systemtic Name: 5-chloranyl-1-pyrimidin-2-yl-3-(trifluoromethyl)pyrazole-4-carboxylic acid Openeye Name: 5-chloro-1-pyrimidin-2-yl-3-(trifluoromethyl)pyrazole-4-carboxylic acid CAS Name: 5-chloro-1-(2-pyrimidinyl)-3-(trifluoromethyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-chloro-1-pyrimidin-2-yl-3-(trifluoromethyl)pyrazole-4-carboxylic acid Traditional Name: 5-chloro-1-(2-pyrimidyl)-3-(trifluoromethyl)pyrazole-4-carboxylic acid Formula: C9H4ClF3N4O2 MolecularWeight: 292.60187

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)N2C(=C(C(=N2)C(F)(F)F)C(=O)O)Cl

Isomeric SMILES

C1=CN=C(N=C1)N2C(=C(C(=N2)C(F)(F)F)C(=O)O)Cl

InChI

InChI=1S/C9H4ClF3N4O2/c10-6-4(7(18)19)5(9(11,12)13)16-17(6)8-14-2-1-3-15-8/h1-3H,(H,18,19)