9-[(2S,3R,4R)-3-phenylmethoxy-4-(phenylmethoxymethyl)oxetan-2-yl]purin-6-amine

Systemtic Name: 9-[(2S,3R,4R)-3-phenylmethoxy-4-(phenylmethoxymethyl)oxetan-2-yl]purin-6-amine Openeye Name: 9-[(2S,3R,4R)-3-benzyloxy-4-(benzyloxymethyl)oxetan-2-yl]purin-6-amine CAS Name: 9-[(2S,3R,4R)-3-phenylmethoxy-4-(phenylmethoxymethyl)-2-oxetanyl]-6-purinamine IUPAC Name: 9-[(2S,3R,4R)-3-phenylmethoxy-4-(phenylmethoxymethyl)oxetan-2-yl]purin-6-amine Traditional Name: [9-[(2S,3R,4R)-3-benzoxy-4-(benzoxymethyl)oxetan-2-yl]purin-6-yl]amine Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2C(C(O2)N3C=NC4=C3N=CN=C4N)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC[C@@H]2[C@H]([C@H](O2)N3C=NC4=C3N=CN=C4N)OCC5=CC=CC=C5

InChI

InChI=1S/C23H23N5O3/c24-21-19-22(26-14-25-21)28(15-27-19)23-20(30-12-17-9-5-2-6-10-17)18(31-23)13-29-11-16-7-3-1-4-8-16/h1-10,14-15,18,20,23H,11-13H2,(H2,24,25,26)/t18-,20-,23+/m1/s1