4-azanyl-2-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-[[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 4-amino-2-[[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-[[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 4-amino-2-[[4-(2-chloro-6-fluoro-benzyl)piperazino]methyl]isoindoline-1,3-quinone Formula: C20H20ClFN4O2 MolecularWeight: 402.849803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC=C2Cl)F)CN3C(=O)C4=C(C3=O)C(=CC=C4)N

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC=C2Cl)F)CN3C(=O)C4=C(C3=O)C(=CC=C4)N

InChI

InChI=1S/C20H20ClFN4O2/c21-15-4-2-5-16(22)14(15)11-24-7-9-25(10-8-24)12-26-19(27)13-3-1-6-17(23)18(13)20(26)28/h1-6H,7-12,23H2