6-azanyl-2-(2-azidoethoxy)-9-(phenylmethyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(2-azidoethoxy)-9-(phenylmethyl)-7H-purin-8-one Openeye Name: 6-amino-2-(2-azidoethoxy)-9-benzyl-7H-purin-8-one CAS Name: 6-amino-2-(2-azidoethoxy)-9-(phenylmethyl)-7H-purin-8-one IUPAC Name: 6-amino-2-(2-azidoethoxy)-9-benzyl-7H-purin-8-one Traditional Name: 6-amino-2-(2-azidoethoxy)-9-benzyl-7H-purin-8-one Formula: C14H14N8O2 MolecularWeight: 326.31336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)OCCN=[N+]=[N-])N)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)OCCN=[N+]=[N-])N)NC2=O

InChI

InChI=1S/C14H14N8O2/c15-11-10-12(20-13(19-11)24-7-6-17-21-16)22(14(23)18-10)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,18,23)(H2,15,19,20)