6-methyl-4-oxidanylidene-2-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-4-oxidanylidene-2-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-4-oxo-2-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-4-oxo-2-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-4-oxo-2-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-keto-6-methyl-2-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxylic acid Formula: C13H9F3N2O3 MolecularWeight: 298.21737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=CC(=CC=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=CC(=CC=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H9F3N2O3/c1-6-9(12(20)21)11(19)18-10(17-6)7-3-2-4-8(5-7)13(14,15)16/h2-5H,1H3,(H,20,21)(H,17,18,19)