6-chloranyl-9-[(1R,2R,3R)-3-fluoranyl-3-(iodanylmethyl)-2-[(triphenylmethyl)oxymethyl]cyclobutyl]purine

Systemtic Name: 6-chloranyl-9-[(1R,2R,3R)-3-fluoranyl-3-(iodanylmethyl)-2-[(triphenylmethyl)oxymethyl]cyclobutyl]purine Openeye Name: 6-chloro-9-[(1R,2R,3R)-3-fluoro-3-(iodomethyl)-2-(trityloxymethyl)cyclobutyl]purine CAS Name: 6-chloro-9-[(1R,2R,3R)-3-fluoro-3-(iodomethyl)-2-[(triphenylmethyl)oxymethyl]cyclobutyl]purine IUPAC Name: 6-chloro-9-[(1R,2R,3R)-3-fluoro-3-(iodomethyl)-2-(trityloxymethyl)cyclobutyl]purine Traditional Name: 6-chloro-9-[(1R,2R,3R)-3-fluoro-3-(iodomethyl)-2-(trityloxymethyl)cyclobutyl]purine Formula: C30H25ClFIN4O MolecularWeight: 638.901573

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C1(CI)F)COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N5C=NC6=C5N=CN=C6Cl

Isomeric SMILES

C1[C@H]([C@@H]([C@]1(CI)F)COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)N5C=NC6=C5N=CN=C6Cl

InChI

InChI=1S/C30H25ClFIN4O/c31-27-26-28(35-19-34-27)37(20-36-26)25-16-29(32,18-33)24(25)17-38-30(21-10-4-1-5-11-21,22-12-6-2-7-13-22)23-14-8-3-9-15-23/h1-15,19-20,24-25H,16-18H2/t24-,25+,29-/m0/s1