9-(oxan-2-yl)-2,6,8-triphenyl-purine

Systemtic Name: 9-(oxan-2-yl)-2,6,8-triphenyl-purine Openeye Name: 2,6,8-triphenyl-9-tetrahydropyran-2-yl-purine CAS Name: 9-(2-oxanyl)-2,6,8-triphenylpurine IUPAC Name: 9-(oxan-2-yl)-2,6,8-triphenylpurine Traditional Name: 2,6,8-triphenyl-9-tetrahydropyran-2-yl-purine Formula: C28H24N4O MolecularWeight: 432.51636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2C(=NC3=C(N=C(N=C32)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCOC(C1)N2C(=NC3=C(N=C(N=C32)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C28H24N4O/c1-4-12-20(13-5-1)24-25-28(31-26(29-24)21-14-6-2-7-15-21)32(23-18-10-11-19-33-23)27(30-25)22-16-8-3-9-17-22/h1-9,12-17,23H,10-11,18-19H2