N-(1,3-benzodioxol-5-yl)-7H-purin-6-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-7H-purin-6-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-7H-purin-6-amine CAS Name: N-(1,3-benzodioxol-5-yl)-7H-purin-6-amine IUPAC Name: N-(1,3-benzodioxol-5-yl)-7H-purin-6-amine Traditional Name: 1,3-benzodioxol-5-yl(7H-purin-6-yl)amine Formula: C12H9N5O2 MolecularWeight: 255.23216

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C12H9N5O2/c1-2-8-9(19-6-18-8)3-7(1)17-12-10-11(14-4-13-10)15-5-16-12/h1-5H,6H2,(H2,13,14,15,16,17)