9-(1,3-benzodioxol-5-yl)-6-chloranyl-purine

Systemtic Name: 9-(1,3-benzodioxol-5-yl)-6-chloranyl-purine Openeye Name: 9-(1,3-benzodioxol-5-yl)-6-chloro-purine CAS Name: 9-(1,3-benzodioxol-5-yl)-6-chloropurine IUPAC Name: 9-(1,3-benzodioxol-5-yl)-6-chloropurine Traditional Name: 9-(1,3-benzodioxol-5-yl)-6-chloro-purine Formula: C12H7ClN4O2 MolecularWeight: 274.66258

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N3C=NC4=C3N=CN=C4Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N3C=NC4=C3N=CN=C4Cl

InChI

InChI=1S/C12H7ClN4O2/c13-11-10-12(15-4-14-11)17(5-16-10)7-1-2-8-9(3-7)19-6-18-8/h1-5H,6H2