2-[bis(fluoranyl)methyl]-5-butyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione

Systemtic Name: 2-[bis(fluoranyl)methyl]-5-butyl-3H-pyrano[2,3-d]pyrimidine-4,7-dione Openeye Name: 5-butyl-2-(difluoromethyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione CAS Name: 5-butyl-2-(difluoromethyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione IUPAC Name: 5-butyl-2-(difluoromethyl)-3H-pyrano[2,3-d]pyrimidine-4,7-dione Traditional Name: 5-butyl-2-(difluoromethyl)-3H-pyrano[2,3-d]pyrimidine-4,7-quinone Formula: C12H12F2N2O3 MolecularWeight: 270.232086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C(=O)NC(=N2)C(F)F

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C(=O)NC(=N2)C(F)F

InChI

InChI=1S/C12H12F2N2O3/c1-2-3-4-6-5-7(17)19-12-8(6)11(18)15-10(16-12)9(13)14/h5,9H,2-4H2,1H3,(H,15,16,18)