2-[3-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[4-(2-chloro-4-fluoro-benzyl)piperazino]propyl]isoindoline-1,3-quinone Formula: C22H23ClFN3O2 MolecularWeight: 415.888323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C(=O)C3=CC=CC=C3C2=O)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCN1CCCN2C(=O)C3=CC=CC=C3C2=O)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C22H23ClFN3O2/c23-20-14-17(24)7-6-16(20)15-26-12-10-25(11-13-26)8-3-9-27-21(28)18-4-1-2-5-19(18)22(27)29/h1-2,4-7,14H,3,8-13,15H2