4-[4-(1-ethanoylpiperidin-4-yl)carbonylpiperazin-1-yl]-2-[(3-fluorophenyl)methyl]isoindole-1,3-dione

Systemtic Name: 4-[4-(1-ethanoylpiperidin-4-yl)carbonylpiperazin-1-yl]-2-[(3-fluorophenyl)methyl]isoindole-1,3-dione Openeye Name: 4-[4-(1-acetylpiperidine-4-carbonyl)piperazin-1-yl]-2-[(3-fluorophenyl)methyl]isoindoline-1,3-dione CAS Name: 4-[4-[(1-acetyl-4-piperidinyl)-oxomethyl]-1-piperazinyl]-2-[(3-fluorophenyl)methyl]isoindole-1,3-dione IUPAC Name: 4-[4-(1-acetylpiperidine-4-carbonyl)piperazin-1-yl]-2-[(3-fluorophenyl)methyl]isoindole-1,3-dione Traditional Name: 4-[4-(1-acetylisonipecotoyl)piperazino]-2-(3-fluorobenzyl)isoindoline-1,3-quinone Formula: C27H29FN4O4 MolecularWeight: 492.541963

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC(=CC=C5)F

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)N2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)CC5=CC(=CC=C5)F

InChI

InChI=1S/C27H29FN4O4/c1-18(33)29-10-8-20(9-11-29)25(34)31-14-12-30(13-15-31)23-7-3-6-22-24(23)27(36)32(26(22)35)17-19-4-2-5-21(28)16-19/h2-7,16,20H,8-15,17H2,1H3