5-bromanyl-2-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione

Systemtic Name: 5-bromanyl-2-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 5-bromo-2-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 5-bromo-2-[4-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 5-bromo-2-[4-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-4-oxobutyl]isoindole-1,3-dione Traditional Name: 5-bromo-2-[4-[4-(2-fluorobenzyl)piperazino]-4-keto-butyl]isoindoline-1,3-quinone Formula: C23H23BrFN3O3 MolecularWeight: 488.349423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2F)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2F)C(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C23H23BrFN3O3/c24-17-7-8-18-19(14-17)23(31)28(22(18)30)9-3-6-21(29)27-12-10-26(11-13-27)15-16-4-1-2-5-20(16)25/h1-2,4-5,7-8,14H,3,6,9-13,15H2