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

Systemtic Name: 2-[3-[bis(fluoranyl)methoxy]phenyl]-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-[3-(difluoromethoxy)phenyl]-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 2-[3-(difluoromethoxy)phenyl]-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 2-[3-(difluoromethoxy)phenyl]-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-[3-(difluoromethoxy)phenyl]-4-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C13H10F2N2O4 MolecularWeight: 296.226306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10F2N2O4/c1-6-9(12(19)20)11(18)17-10(16-6)7-3-2-4-8(5-7)21-13(14)15/h2-5,13H,1H3,(H,19,20)(H,16,17,18)