4-[4-(4-nitrophenyl)piperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(4-nitrophenyl)-1-piperazinyl]-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(4-nitrophenyl)piperazin-1-yl]-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-[4-(4-nitrophenyl)piperazino]-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C21H19N7O2 MolecularWeight: 401.42126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

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