4-[2-[(6-azanyl-8-bromanyl-9-ethyl-purin-2-yl)amino]ethyl]benzene-1,2-diol

Systemtic Name: 4-[2-[(6-azanyl-8-bromanyl-9-ethyl-purin-2-yl)amino]ethyl]benzene-1,2-diol Openeye Name: 4-[2-[(6-amino-8-bromo-9-ethyl-purin-2-yl)amino]ethyl]benzene-1,2-diol CAS Name: 4-[2-[(6-amino-8-bromo-9-ethyl-2-purinyl)amino]ethyl]benzene-1,2-diol IUPAC Name: 4-[2-[(6-amino-8-bromo-9-ethylpurin-2-yl)amino]ethyl]benzene-1,2-diol Traditional Name: 4-[2-[(6-amino-8-bromo-9-ethyl-purin-2-yl)amino]ethyl]pyrocatechol Formula: C15H17BrN6O2 MolecularWeight: 393.23848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)NCCC3=CC(=C(C=C3)O)O)N)N=C1Br

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)NCCC3=CC(=C(C=C3)O)O)N)N=C1Br

InChI

InChI=1S/C15H17BrN6O2/c1-2-22-13-11(19-14(22)16)12(17)20-15(21-13)18-6-5-8-3-4-9(23)10(24)7-8/h3-4,7,23-24H,2,5-6H2,1H3,(H3,17,18,20,21)