N-[9-(3-azido-2-oxidanyl-propyl)purin-6-yl]benzamide

Systemtic Name: N-[9-(3-azido-2-oxidanyl-propyl)purin-6-yl]benzamide Openeye Name: N-[9-(3-azido-2-hydroxy-propyl)purin-6-yl]benzamide CAS Name: N-[9-(3-azido-2-hydroxypropyl)-6-purinyl]benzamide IUPAC Name: N-[9-(3-azido-2-hydroxypropyl)purin-6-yl]benzamide Traditional Name: N-[9-(3-azido-2-hydroxy-propyl)purin-6-yl]benzamide Formula: C15H14N8O2 MolecularWeight: 338.32406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2N=CN3CC(CN=[N+]=[N-])O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC=NC3=C2N=CN3CC(CN=[N+]=[N-])O

InChI

InChI=1S/C15H14N8O2/c16-22-20-6-11(24)7-23-9-19-12-13(17-8-18-14(12)23)21-15(25)10-4-2-1-3-5-10/h1-5,8-9,11,24H,6-7H2,(H,17,18,21,25)