4,7-bis(chloranyl)-2-[2-[4-(6-fluoranyl-2,1-benzoxazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 4,7-bis(chloranyl)-2-[2-[4-(6-fluoranyl-2,1-benzoxazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 4,7-dichloro-2-[2-[4-(6-fluoro-2,1-benzoxazol-3-yl)-1-piperidyl]ethyl]isoindoline-1,3-dione CAS Name: 4,7-dichloro-2-[2-[4-(6-fluoro-2,1-benzoxazol-3-yl)-1-piperidinyl]ethyl]isoindole-1,3-dione IUPAC Name: 4,7-dichloro-2-[2-[4-(6-fluoro-2,1-benzoxazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 4,7-dichloro-2-[2-[4-(6-fluoroanthranil-3-yl)piperidino]ethyl]isoindoline-1,3-quinone Formula: C22H18Cl2FN3O3 MolecularWeight: 462.301023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=C3C=CC(=CC3=NO2)F)CCN4C(=O)C5=C(C=CC(=C5C4=O)Cl)Cl

Isomeric SMILES

C1CN(CCC1C2=C3C=CC(=CC3=NO2)F)CCN4C(=O)C5=C(C=CC(=C5C4=O)Cl)Cl

InChI

InChI=1S/C22H18Cl2FN3O3/c23-15-3-4-16(24)19-18(15)21(29)28(22(19)30)10-9-27-7-5-12(6-8-27)20-14-2-1-13(25)11-17(14)26-31-20/h1-4,11-12H,5-10H2