9-(oxiran-2-ylmethyl)-6-(2-phenylethynyl)purine

Systemtic Name: 9-(oxiran-2-ylmethyl)-6-(2-phenylethynyl)purine Openeye Name: 9-(oxiran-2-ylmethyl)-6-(2-phenylethynyl)purine CAS Name: 9-(2-oxiranylmethyl)-6-(2-phenylethynyl)purine IUPAC Name: 9-(oxiran-2-ylmethyl)-6-(2-phenylethynyl)purine Traditional Name: 9-glycidyl-6-(2-phenylethynyl)purine Formula: C16H12N4O MolecularWeight: 276.29268

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)CN2C=NC3=C(N=CN=C32)C#CC4=CC=CC=C4

Isomeric SMILES

C1C(O1)CN2C=NC3=C(N=CN=C32)C#CC4=CC=CC=C4

InChI

InChI=1S/C16H12N4O/c1-2-4-12(5-3-1)6-7-14-15-16(18-10-17-14)20(11-19-15)8-13-9-21-13/h1-5,10-11,13H,8-9H2