5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]carbonyl-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]carbonyl-2-methyl-isoindole-1,3-dione Openeye Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]-2-methyl-isoindoline-1,3-dione CAS Name: 5-[[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-2-methylisoindole-1,3-dione IUPAC Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]-2-methylisoindole-1,3-dione Traditional Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]-2-methyl-isoindoline-1,3-quinone Formula: C27H23F2N3O3 MolecularWeight: 475.486626

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H23F2N3O3/c1-30-26(34)22-11-6-19(16-23(22)27(30)35)25(33)32-14-12-31(13-15-32)24(17-2-7-20(28)8-3-17)18-4-9-21(29)10-5-18/h2-11,16,24H,12-15H2,1H3