2-[2-[4-(6-fluoranyl-1H-indazol-3-yl)piperazin-1-yl]ethyl]-5-methyl-isoindole-1,3-dione

Systemtic Name: 2-[2-[4-(6-fluoranyl-1H-indazol-3-yl)piperazin-1-yl]ethyl]-5-methyl-isoindole-1,3-dione Openeye Name: 2-[2-[4-(6-fluoro-1H-indazol-3-yl)piperazin-1-yl]ethyl]-5-methyl-isoindoline-1,3-dione CAS Name: 2-[2-[4-(6-fluoro-1H-indazol-3-yl)-1-piperazinyl]ethyl]-5-methylisoindole-1,3-dione IUPAC Name: 2-[2-[4-(6-fluoro-1H-indazol-3-yl)piperazin-1-yl]ethyl]-5-methylisoindole-1,3-dione Traditional Name: 2-[2-[4-(6-fluoro-1H-indazol-3-yl)piperazino]ethyl]-5-methyl-isoindoline-1,3-quinone Formula: C22H22FN5O2 MolecularWeight: 407.440783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCN3CCN(CC3)C4=NNC5=C4C=CC(=C5)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCN3CCN(CC3)C4=NNC5=C4C=CC(=C5)F

InChI

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