2-(3-ethoxypropoxy)-9-(phenylmethyl)purin-6-amine

Systemtic Name: 2-(3-ethoxypropoxy)-9-(phenylmethyl)purin-6-amine Openeye Name: 9-benzyl-2-(3-ethoxypropoxy)purin-6-amine CAS Name: 2-(3-ethoxypropoxy)-9-(phenylmethyl)-6-purinamine IUPAC Name: 9-benzyl-2-(3-ethoxypropoxy)purin-6-amine Traditional Name: [9-benzyl-2-(3-ethoxypropoxy)purin-6-yl]amine Formula: C17H21N5O2 MolecularWeight: 327.38094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCOC1=NC2=C(C(=N1)N)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CCOCCCOC1=NC2=C(C(=N1)N)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C17H21N5O2/c1-2-23-9-6-10-24-17-20-15(18)14-16(21-17)22(12-19-14)11-13-7-4-3-5-8-13/h3-5,7-8,12H,2,6,9-11H2,1H3,(H2,18,20,21)