3-[2,4-bis(fluoranyl)phenyl]-1-(2-methoxyethyl)-7H-purine-2,6-dione

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-(2-methoxyethyl)-7H-purine-2,6-dione Openeye Name: 3-(2,4-difluorophenyl)-1-(2-methoxyethyl)-7H-purine-2,6-dione CAS Name: 3-(2,4-difluorophenyl)-1-(2-methoxyethyl)-7H-purine-2,6-dione IUPAC Name: 3-(2,4-difluorophenyl)-1-(2-methoxyethyl)-7H-purine-2,6-dione Traditional Name: 3-(2,4-difluorophenyl)-1-(2-methoxyethyl)-7H-purine-2,6-quinone Formula: C14H12F2N4O3 MolecularWeight: 322.266886

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(N=CN2)N(C1=O)C3=C(C=C(C=C3)F)F

Isomeric SMILES

COCCN1C(=O)C2=C(N=CN2)N(C1=O)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C14H12F2N4O3/c1-23-5-4-19-13(21)11-12(18-7-17-11)20(14(19)22)10-3-2-8(15)6-9(10)16/h2-3,6-7H,4-5H2,1H3,(H,17,18)