2-[2-[2-[(4-fluorophenyl)methyl]-2-pyridin-2-yl-piperazin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-[(4-fluorophenyl)methyl]-2-pyridin-2-yl-piperazin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-[(4-fluorophenyl)methyl]-2-(2-pyridyl)piperazin-1-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-[(4-fluorophenyl)methyl]-2-(2-pyridinyl)-1-piperazinyl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-[(4-fluorophenyl)methyl]-2-pyridin-2-ylpiperazin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-(4-fluorobenzyl)-2-(2-pyridyl)piperazino]ethyl]isoindoline-1,3-quinone Formula: C26H25FN4O2 MolecularWeight: 444.500703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)(CC2=CC=C(C=C2)F)C3=CC=CC=N3)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1CN(C(CN1)(CC2=CC=C(C=C2)F)C3=CC=CC=N3)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H25FN4O2/c27-20-10-8-19(9-11-20)17-26(23-7-3-4-12-29-23)18-28-13-14-30(26)15-16-31-24(32)21-5-1-2-6-22(21)25(31)33/h1-12,28H,13-18H2