7-[(4-fluorophenyl)methyl]-9H-purin-7-ium

Systemtic Name: 7-[(4-fluorophenyl)methyl]-9H-purin-7-ium Openeye Name: 7-[(4-fluorophenyl)methyl]-9H-purin-7-ium CAS Name: 7-[(4-fluorophenyl)methyl]-9H-purin-7-ium IUPAC Name: 7-[(4-fluorophenyl)methyl]-9H-purin-7-ium Traditional Name: 7-(4-fluorobenzyl)-9H-purin-7-ium Formula: C12H10FN4+ MolecularWeight: 229.233003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[N+]2=CNC3=NC=NC=C32)F

Isomeric SMILES

C1=CC(=CC=C1C[N+]2=CNC3=NC=NC=C32)F

InChI

InChI=1S/C12H9FN4/c13-10-3-1-9(2-4-10)6-17-8-16-12-11(17)5-14-7-15-12/h1-5,7-8H,6H2/p+1