4-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carboxylic acid

Systemtic Name: 4-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carboxylic acid Openeye Name: 4-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carboxylic acid CAS Name: 4-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]-5-pyrimidinecarboxylic acid IUPAC Name: 4-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carboxylic acid Traditional Name: 4-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine-5-carboxylic acid Formula: C13H6F6N2O2 MolecularWeight: 336.189359

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=C(C(=N2)C(F)(F)F)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC=C(C(=N2)C(F)(F)F)C(=O)O)C(F)(F)F

InChI

InChI=1S/C13H6F6N2O2/c14-12(15,16)7-3-1-6(2-4-7)10-20-5-8(11(22)23)9(21-10)13(17,18)19/h1-5H,(H,22,23)