9-(4-azanyl-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl)purin-6-amine

Systemtic Name: 9-(4-azanyl-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl)purin-6-amine Openeye Name: 9-(4-amino-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl)purin-6-amine CAS Name: 9-(4-amino-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl)-6-purinamine IUPAC Name: 9-(4-amino-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl)purin-6-amine Traditional Name: (4-adenin-9-yl-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl)amine Formula: C13H18N6 MolecularWeight: 258.32222

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2C1C(CC2)N3C=NC4=C3N=CN=C4N)N

Isomeric SMILES

C1CC(C2C1C(CC2)N3C=NC4=C3N=CN=C4N)N

InChI

InChI=1S/C13H18N6/c14-9-3-1-8-7(9)2-4-10(8)19-6-18-11-12(15)16-5-17-13(11)19/h5-10H,1-4,14H2,(H2,15,16,17)