9-[2-[2-[bis(fluoranyl)methoxy]phenyl]-2-oxidanylidene-ethyl]-3-methyl-6-oxidanylidene-purin-2-olate

Systemtic Name: 9-[2-[2-[bis(fluoranyl)methoxy]phenyl]-2-oxidanylidene-ethyl]-3-methyl-6-oxidanylidene-purin-2-olate Openeye Name: 9-[2-[2-(difluoromethoxy)phenyl]-2-oxo-ethyl]-3-methyl-6-oxo-purin-2-olate CAS Name: 9-[2-[2-(difluoromethoxy)phenyl]-2-oxoethyl]-3-methyl-6-oxo-2-purinolate IUPAC Name: 9-[2-[2-(difluoromethoxy)phenyl]-2-oxoethyl]-3-methyl-6-oxopurin-2-olate Traditional Name: 9-[2-[2-(difluoromethoxy)phenyl]-2-keto-ethyl]-6-keto-3-methyl-purin-2-olate Formula: C15H11F2N4O4- MolecularWeight: 349.269046

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N=C1[O-])N=CN2CC(=O)C3=CC=CC=C3OC(F)F

Isomeric SMILES

CN1C2=C(C(=O)N=C1[O-])N=CN2CC(=O)C3=CC=CC=C3OC(F)F

InChI

InChI=1S/C15H12F2N4O4/c1-20-13-11(12(23)19-15(20)24)18-7-21(13)6-9(22)8-4-2-3-5-10(8)25-14(16)17/h2-5,7,14H,6H2,1H3,(H,19,23,24)/p-1