3-[2-morpholin-4-yl-9-[[3-(trifluoromethyloxy)phenyl]methyl]purin-6-yl]phenol

Systemtic Name: 3-[2-morpholin-4-yl-9-[[3-(trifluoromethyloxy)phenyl]methyl]purin-6-yl]phenol Openeye Name: 3-[2-morpholino-9-[[3-(trifluoromethoxy)phenyl]methyl]purin-6-yl]phenol CAS Name: 3-[2-(4-morpholinyl)-9-[[3-(trifluoromethoxy)phenyl]methyl]-6-purinyl]phenol IUPAC Name: 3-[2-morpholin-4-yl-9-[[3-(trifluoromethoxy)phenyl]methyl]purin-6-yl]phenol Traditional Name: 3-[2-morpholino-9-[3-(trifluoromethoxy)benzyl]purin-6-yl]phenol Formula: C23H20F3N5O3 MolecularWeight: 471.43181

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=C3C(=N2)N(C=N3)CC4=CC(=CC=C4)OC(F)(F)F)C5=CC(=CC=C5)O

Isomeric SMILES

C1COCCN1C2=NC(=C3C(=N2)N(C=N3)CC4=CC(=CC=C4)OC(F)(F)F)C5=CC(=CC=C5)O

InChI

InChI=1S/C23H20F3N5O3/c24-23(25,26)34-18-6-1-3-15(11-18)13-31-14-27-20-19(16-4-2-5-17(32)12-16)28-22(29-21(20)31)30-7-9-33-10-8-30/h1-6,11-12,14,32H,7-10,13H2