5-fluoranyl-2-[2-[4-(1H-indazol-3-yl)piperazin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 5-fluoranyl-2-[2-[4-(1H-indazol-3-yl)piperazin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 5-fluoro-2-[2-[4-(1H-indazol-3-yl)piperazin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 5-fluoro-2-[2-[4-(1H-indazol-3-yl)-1-piperazinyl]ethyl]isoindole-1,3-dione IUPAC Name: 5-fluoro-2-[2-[4-(1H-indazol-3-yl)piperazin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 5-fluoro-2-[2-[4-(1H-indazol-3-yl)piperazino]ethyl]isoindoline-1,3-quinone Formula: C21H20FN5O2 MolecularWeight: 393.414203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C(=O)C3=C(C2=O)C=C(C=C3)F)C4=NNC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCN2C(=O)C3=C(C2=O)C=C(C=C3)F)C4=NNC5=CC=CC=C54

InChI

InChI=1S/C21H20FN5O2/c22-14-5-6-15-17(13-14)21(29)27(20(15)28)12-9-25-7-10-26(11-8-25)19-16-3-1-2-4-18(16)23-24-19/h1-6,13H,7-12H2,(H,23,24)