N-[9-(3-fluoranyl-2-oxidanyl-propyl)-6-oxidanylidene-3H-purin-2-yl]benzamide

Systemtic Name: N-[9-(3-fluoranyl-2-oxidanyl-propyl)-6-oxidanylidene-3H-purin-2-yl]benzamide Openeye Name: N-[9-(3-fluoro-2-hydroxy-propyl)-6-oxo-3H-purin-2-yl]benzamide CAS Name: N-[9-(3-fluoro-2-hydroxypropyl)-6-oxo-3H-purin-2-yl]benzamide IUPAC Name: N-[9-(3-fluoro-2-hydroxypropyl)-6-oxo-3H-purin-2-yl]benzamide Traditional Name: N-[9-(3-fluoro-2-hydroxy-propyl)-6-keto-3H-purin-2-yl]benzamide Formula: C15H14FN5O3 MolecularWeight: 331.301763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC(=O)C3=C(N2)N(C=N3)CC(CF)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC(=O)C3=C(N2)N(C=N3)CC(CF)O

InChI

InChI=1S/C15H14FN5O3/c16-6-10(22)7-21-8-17-11-12(21)18-15(20-14(11)24)19-13(23)9-4-2-1-3-5-9/h1-5,8,10,22H,6-7H2,(H2,18,19,20,23,24)