3-(6-chloranylpurin-9-yl)-1-methyl-5-(trifluoromethyloxy)cyclopentane-1,2-diol

Systemtic Name: 3-(6-chloranylpurin-9-yl)-1-methyl-5-(trifluoromethyloxy)cyclopentane-1,2-diol Openeye Name: 3-(6-chloropurin-9-yl)-1-methyl-5-(trifluoromethoxy)cyclopentane-1,2-diol CAS Name: 3-(6-chloro-9-purinyl)-1-methyl-5-(trifluoromethoxy)cyclopentane-1,2-diol IUPAC Name: 3-(6-chloropurin-9-yl)-1-methyl-5-(trifluoromethoxy)cyclopentane-1,2-diol Traditional Name: 3-(6-chloropurin-9-yl)-1-methyl-5-(trifluoromethoxy)cyclopentane-1,2-diol Formula: C12H12ClF3N4O3 MolecularWeight: 352.69689

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC(C1O)N2C=NC3=C2N=CN=C3Cl)OC(F)(F)F)O

Isomeric SMILES

CC1(C(CC(C1O)N2C=NC3=C2N=CN=C3Cl)OC(F)(F)F)O

InChI

InChI=1S/C12H12ClF3N4O3/c1-11(22)6(23-12(14,15)16)2-5(8(11)21)20-4-19-7-9(13)17-3-18-10(7)20/h3-6,8,21-22H,2H2,1H3