2-fluoranyl-N-methyl-9-[(3-nitrophenyl)methyl]purin-6-amine

Systemtic Name: 2-fluoranyl-N-methyl-9-[(3-nitrophenyl)methyl]purin-6-amine Openeye Name: 2-fluoro-N-methyl-9-[(3-nitrophenyl)methyl]purin-6-amine CAS Name: 2-fluoro-N-methyl-9-[(3-nitrophenyl)methyl]-6-purinamine IUPAC Name: 2-fluoro-N-methyl-9-[(3-nitrophenyl)methyl]purin-6-amine Traditional Name: [2-fluoro-9-(3-nitrobenzyl)purin-6-yl]-methyl-amine Formula: C13H11FN6O2 MolecularWeight: 302.263843

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=CN2CC3=CC(=CC=C3)[N+](=O)[O-])F

Isomeric SMILES

CNC1=NC(=NC2=C1N=CN2CC3=CC(=CC=C3)[N+](=O)[O-])F

InChI

InChI=1S/C13H11FN6O2/c1-15-11-10-12(18-13(14)17-11)19(7-16-10)6-8-3-2-4-9(5-8)20(21)22/h2-5,7H,6H2,1H3,(H,15,17,18)