8-(1,3-benzodioxol-5-ylmethyl)-2-fluoranyl-7H-purin-6-amine

Systemtic Name: 8-(1,3-benzodioxol-5-ylmethyl)-2-fluoranyl-7H-purin-6-amine Openeye Name: 8-(1,3-benzodioxol-5-ylmethyl)-2-fluoro-7H-purin-6-amine CAS Name: 8-(1,3-benzodioxol-5-ylmethyl)-2-fluoro-7H-purin-6-amine IUPAC Name: 8-(1,3-benzodioxol-5-ylmethyl)-2-fluoro-7H-purin-6-amine Traditional Name: (2-fluoro-8-piperonyl-7H-purin-6-yl)amine Formula: C13H10FN5O2 MolecularWeight: 287.249203

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CC3=NC4=C(N3)C(=NC(=N4)F)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CC3=NC4=C(N3)C(=NC(=N4)F)N

InChI

InChI=1S/C13H10FN5O2/c14-13-18-11(15)10-12(19-13)17-9(16-10)4-6-1-2-7-8(3-6)21-5-20-7/h1-3H,4-5H2,(H3,15,16,17,18,19)