6-[4-(4-nitrophenyl)piperazin-1-yl]-9-phenyl-purine

Systemtic Name: 6-[4-(4-nitrophenyl)piperazin-1-yl]-9-phenyl-purine Openeye Name: 6-[4-(4-nitrophenyl)piperazin-1-yl]-9-phenyl-purine CAS Name: 6-[4-(4-nitrophenyl)-1-piperazinyl]-9-phenylpurine IUPAC Name: 6-[4-(4-nitrophenyl)piperazin-1-yl]-9-phenylpurine Traditional Name: 6-[4-(4-nitrophenyl)piperazino]-9-phenyl-purine Formula: C21H19N7O2 MolecularWeight: 401.42126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC=NC4=C3N=CN4C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC=NC4=C3N=CN4C5=CC=CC=C5

InChI

InChI=1S/C21H19N7O2/c29-28(30)18-8-6-16(7-9-18)25-10-12-26(13-11-25)20-19-21(23-14-22-20)27(15-24-19)17-4-2-1-3-5-17/h1-9,14-15H,10-13H2