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

Systemtic Name: 4-[3,4-bis(fluoranyl)phenyl]-1,3,6-triethyl-2-oxidanylidene-4H-pyrimidine-5-carboxylic acid Openeye Name: 4-(3,4-difluorophenyl)-1,3,6-triethyl-2-oxo-4H-pyrimidine-5-carboxylic acid CAS Name: 4-(3,4-difluorophenyl)-1,3,6-triethyl-2-oxo-4H-pyrimidine-5-carboxylic acid IUPAC Name: 4-(3,4-difluorophenyl)-1,3,6-triethyl-2-oxo-4H-pyrimidine-5-carboxylic acid Traditional Name: 4-(3,4-difluorophenyl)-1,3,6-triethyl-2-keto-4H-pyrimidine-5-carboxylic acid Formula: C17H20F2N2O3 MolecularWeight: 338.349106

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(N(C(=O)N1CC)CC)C2=CC(=C(C=C2)F)F)C(=O)O

Isomeric SMILES

CCC1=C(C(N(C(=O)N1CC)CC)C2=CC(=C(C=C2)F)F)C(=O)O

InChI

InChI=1S/C17H20F2N2O3/c1-4-13-14(16(22)23)15(10-7-8-11(18)12(19)9-10)21(6-3)17(24)20(13)5-2/h7-9,15H,4-6H2,1-3H3,(H,22,23)