9-[(2-fluoranyl-5-nitro-phenyl)methyl]-6-(furan-2-yl)purin-2-amine

Systemtic Name: 9-[(2-fluoranyl-5-nitro-phenyl)methyl]-6-(furan-2-yl)purin-2-amine Openeye Name: 9-[(2-fluoro-5-nitro-phenyl)methyl]-6-(2-furyl)purin-2-amine CAS Name: 9-[(2-fluoro-5-nitrophenyl)methyl]-6-(2-furanyl)-2-purinamine IUPAC Name: 9-[(2-fluoro-5-nitrophenyl)methyl]-6-(furan-2-yl)purin-2-amine Traditional Name: [9-(2-fluoro-5-nitro-benzyl)-6-(2-furyl)purin-2-yl]amine Formula: C16H11FN6O3 MolecularWeight: 354.295343

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C3C(=NC(=N2)N)N(C=N3)CC4=C(C=CC(=C4)[N+](=O)[O-])F

Isomeric SMILES

C1=COC(=C1)C2=C3C(=NC(=N2)N)N(C=N3)CC4=C(C=CC(=C4)[N+](=O)[O-])F

InChI

InChI=1S/C16H11FN6O3/c17-11-4-3-10(23(24)25)6-9(11)7-22-8-19-14-13(12-2-1-5-26-12)20-16(18)21-15(14)22/h1-6,8H,7H2,(H2,18,20,21)