2,8-bis(chloranyl)-9-(oxan-2-yl)-6-phenyl-purine

Systemtic Name: 2,8-bis(chloranyl)-9-(oxan-2-yl)-6-phenyl-purine Openeye Name: 2,8-dichloro-6-phenyl-9-tetrahydropyran-2-yl-purine CAS Name: 2,8-dichloro-9-(2-oxanyl)-6-phenylpurine IUPAC Name: 2,8-dichloro-9-(oxan-2-yl)-6-phenylpurine Traditional Name: 2,8-dichloro-6-phenyl-9-tetrahydropyran-2-yl-purine Formula: C16H14Cl2N4O MolecularWeight: 349.21456

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2C3=NC(=NC(=C3N=C2Cl)C4=CC=CC=C4)Cl

Isomeric SMILES

C1CCOC(C1)N2C3=NC(=NC(=C3N=C2Cl)C4=CC=CC=C4)Cl

InChI

InChI=1S/C16H14Cl2N4O/c17-15-19-12(10-6-2-1-3-7-10)13-14(21-15)22(16(18)20-13)11-8-4-5-9-23-11/h1-3,6-7,11H,4-5,8-9H2