2-[6-azanyl-8-bromanyl-9-(phenylmethyl)purin-2-yl]oxyethanol

Systemtic Name: 2-[6-azanyl-8-bromanyl-9-(phenylmethyl)purin-2-yl]oxyethanol Openeye Name: 2-(6-amino-9-benzyl-8-bromo-purin-2-yl)oxyethanol CAS Name: 2-[[6-amino-8-bromo-9-(phenylmethyl)-2-purinyl]oxy]ethanol IUPAC Name: 2-(6-amino-9-benzyl-8-bromopurin-2-yl)oxyethanol Traditional Name: 2-(6-amino-9-benzyl-8-bromo-purin-2-yl)oxyethanol Formula: C14H14BrN5O2 MolecularWeight: 364.19726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)OCCO)N)N=C2Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)OCCO)N)N=C2Br

InChI

InChI=1S/C14H14BrN5O2/c15-13-17-10-11(16)18-14(22-7-6-21)19-12(10)20(13)8-9-4-2-1-3-5-9/h1-5,21H,6-8H2,(H2,16,18,19)