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

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-(phenylmethyl)-7H-purine-2,6-dione Openeye Name: 1-benzyl-3-(2,4-difluorophenyl)-7H-purine-2,6-dione CAS Name: 3-(2,4-difluorophenyl)-1-(phenylmethyl)-7H-purine-2,6-dione IUPAC Name: 1-benzyl-3-(2,4-difluorophenyl)-7H-purine-2,6-dione Traditional Name: 1-benzyl-3-(2,4-difluorophenyl)-7H-purine-2,6-quinone Formula: C18H12F2N4O2 MolecularWeight: 354.310286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(N=CN3)N(C2=O)C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(N=CN3)N(C2=O)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C18H12F2N4O2/c19-12-6-7-14(13(20)8-12)24-16-15(21-10-22-16)17(25)23(18(24)26)9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,21,22)