5-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-2-(phenylmethyl)isoindole-1,3-dione

Systemtic Name: 5-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]carbonyl-2-(phenylmethyl)isoindole-1,3-dione Openeye Name: 2-benzyl-5-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 5-[[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-2-(phenylmethyl)isoindole-1,3-dione IUPAC Name: 2-benzyl-5-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-benzyl-5-[4-(2-fluorobenzoyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C27H22FN3O4 MolecularWeight: 471.479683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4)C(=O)C5=CC=CC=C5F

InChI

InChI=1S/C27H22FN3O4/c28-23-9-5-4-8-21(23)25(33)30-14-12-29(13-15-30)24(32)19-10-11-20-22(16-19)27(35)31(26(20)34)17-18-6-2-1-3-7-18/h1-11,16H,12-15,17H2