2-chloranyl-6-(oxolan-2-yl)-9-(phenylmethyl)purine

Systemtic Name: 2-chloranyl-6-(oxolan-2-yl)-9-(phenylmethyl)purine Openeye Name: 9-benzyl-2-chloro-6-tetrahydrofuran-2-yl-purine CAS Name: 2-chloro-6-(2-oxolanyl)-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-2-chloro-6-(oxolan-2-yl)purine Traditional Name: 9-benzyl-2-chloro-6-(tetrahydrofuryl)purine Formula: C16H15ClN4O MolecularWeight: 314.7695

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C2=C3C(=NC(=N2)Cl)N(C=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)C2=C3C(=NC(=N2)Cl)N(C=N3)CC4=CC=CC=C4

InChI

InChI=1S/C16H15ClN4O/c17-16-19-13(12-7-4-8-22-12)14-15(20-16)21(10-18-14)9-11-5-2-1-3-6-11/h1-3,5-6,10,12H,4,7-9H2