4,7-bis(chloranyl)-5-ethyl-6-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]isoindole-1,3-dione

Systemtic Name: 4,7-bis(chloranyl)-5-ethyl-6-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]isoindole-1,3-dione Openeye Name: 4,7-dichloro-5-ethyl-6-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]isoindoline-1,3-dione CAS Name: 4,7-dichloro-5-ethyl-6-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]isoindole-1,3-dione IUPAC Name: 4,7-dichloro-5-ethyl-6-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]isoindole-1,3-dione Traditional Name: 4,7-dichloro-5-ethyl-6-[4-(6-fluoroindoxazen-3-yl)piperidino]isoindoline-1,3-quinone Formula: C22H18Cl2FN3O3 MolecularWeight: 462.301023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C(=C1N3CCC(CC3)C4=NOC5=C4C=CC(=C5)F)Cl)C(=O)NC2=O)Cl

Isomeric SMILES

CCC1=C(C2=C(C(=C1N3CCC(CC3)C4=NOC5=C4C=CC(=C5)F)Cl)C(=O)NC2=O)Cl

InChI

InChI=1S/C22H18Cl2FN3O3/c1-2-12-17(23)15-16(22(30)26-21(15)29)18(24)20(12)28-7-5-10(6-8-28)19-13-4-3-11(25)9-14(13)31-27-19/h3-4,9-10H,2,5-8H2,1H3,(H,26,29,30)