(7R,8S)-7-(6-chloranylpurin-9-yl)-8-phenylmethoxy-nonane-1,2-diol

Systemtic Name: (7R,8S)-7-(6-chloranylpurin-9-yl)-8-phenylmethoxy-nonane-1,2-diol Openeye Name: (7R,8S)-8-benzyloxy-7-(6-chloropurin-9-yl)nonane-1,2-diol CAS Name: (7R,8S)-7-(6-chloro-9-purinyl)-8-phenylmethoxynonane-1,2-diol IUPAC Name: (7R,8S)-7-(6-chloropurin-9-yl)-8-phenylmethoxynonane-1,2-diol Traditional Name: (7R,8S)-8-benzoxy-7-(6-chloropurin-9-yl)nonane-1,2-diol Formula: C21H27ClN4O3 MolecularWeight: 418.91708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCCCC(CO)O)N1C=NC2=C1N=CN=C2Cl)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H]([C@@H](CCCCC(CO)O)N1C=NC2=C1N=CN=C2Cl)OCC3=CC=CC=C3

InChI

InChI=1S/C21H27ClN4O3/c1-15(29-12-16-7-3-2-4-8-16)18(10-6-5-9-17(28)11-27)26-14-25-19-20(22)23-13-24-21(19)26/h2-4,7-8,13-15,17-18,27-28H,5-6,9-12H2,1H3/t15-,17?,18+/m0/s1