8-(1,3-benzodioxol-5-ylmethyl)-9-butyl-purin-6-amine

Systemtic Name: 8-(1,3-benzodioxol-5-ylmethyl)-9-butyl-purin-6-amine Openeye Name: 8-(1,3-benzodioxol-5-ylmethyl)-9-butyl-purin-6-amine CAS Name: 8-(1,3-benzodioxol-5-ylmethyl)-9-butyl-6-purinamine IUPAC Name: 8-(1,3-benzodioxol-5-ylmethyl)-9-butylpurin-6-amine Traditional Name: (9-butyl-8-piperonyl-purin-6-yl)amine Formula: C17H19N5O2 MolecularWeight: 325.36506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1N=CN=C2N)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCN1C(=NC2=C1N=CN=C2N)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H19N5O2/c1-2-3-6-22-14(21-15-16(18)19-9-20-17(15)22)8-11-4-5-12-13(7-11)24-10-23-12/h4-5,7,9H,2-3,6,8,10H2,1H3,(H2,18,19,20)