2-[2-[4-(6-fluoranyl-1H-indazol-3-yl)piperazin-1-yl]ethyl]-4-methyl-isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(6-fluoranyl-1H-indazol-3-yl)piperazin-1-yl]ethyl]-4-methyl-isoindole-1,3-dione Openeye Name: 2-[2-[4-(6-fluoro-1H-indazol-3-yl)piperazin-1-yl]ethyl]-4-methyl-isoindoline-1,3-dione CAS Name: 2-[2-[4-(6-fluoro-1H-indazol-3-yl)-1-piperazinyl]ethyl]-4-methylisoindole-1,3-dione IUPAC Name: 2-[2-[4-(6-fluoro-1H-indazol-3-yl)piperazin-1-yl]ethyl]-4-methylisoindole-1,3-dione Traditional Name: 2-[2-[4-(6-fluoro-1H-indazol-3-yl)piperazino]ethyl]-4-methyl-isoindoline-1,3-quinone Formula: C22H22FN5O2 MolecularWeight: 407.440783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(=O)N(C2=O)CCN3CCN(CC3)C4=NNC5=C4C=CC(=C5)F

Isomeric SMILES

CC1=CC=CC2=C1C(=O)N(C2=O)CCN3CCN(CC3)C4=NNC5=C4C=CC(=C5)F

InChI

InChI=1S/C22H22FN5O2/c1-14-3-2-4-17-19(14)22(30)28(21(17)29)12-9-26-7-10-27(11-8-26)20-16-6-5-15(23)13-18(16)24-25-20/h2-6,13H,7-12H2,1H3,(H,24,25)