2-azanyl-9-[4-(hydroxymethyl)-7-phenylmethoxy-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[4-(hydroxymethyl)-7-phenylmethoxy-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[7-benzyloxy-4-(hydroxymethyl)-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one CAS Name: 2-amino-9-[4-(hydroxymethyl)-7-phenylmethoxy-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-(hydroxymethyl)-7-phenylmethoxy-2,5-dioxabicyclo[2.2.1]heptan-6-yl]-3H-purin-6-one Traditional Name: 2-amino-9-(7-benzoxy-4-methylol-2,5-dioxabicyclo[2.2.1]heptan-6-yl)-3H-purin-6-one Formula: C18H19N5O5 MolecularWeight: 385.37396

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Descriptors Computed from Structure

Canonical SMILES:

C1C2(C(C(O1)C(O2)N3C=NC4=C3NC(=NC4=O)N)OCC5=CC=CC=C5)CO

Isomeric SMILES

C1C2(C(C(O1)C(O2)N3C=NC4=C3NC(=NC4=O)N)OCC5=CC=CC=C5)CO

InChI

InChI=1S/C18H19N5O5/c19-17-21-14-11(15(25)22-17)20-9-23(14)16-12-13(18(7-24,28-16)8-27-12)26-6-10-4-2-1-3-5-10/h1-5,9,12-13,16,24H,6-8H2,(H3,19,21,22,25)