5-tert-butyl-2-[2-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 5-tert-butyl-2-[2-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione Openeye Name: 5-tert-butyl-2-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]ethyl]isoindoline-1,3-dione CAS Name: 5-tert-butyl-2-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]ethyl]isoindole-1,3-dione IUPAC Name: 5-tert-butyl-2-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]isoindole-1,3-dione Traditional Name: 5-tert-butyl-2-[2-[4-(6-fluoroindoxazen-3-yl)piperidino]ethyl]isoindoline-1,3-quinone Formula: C26H28FN3O3 MolecularWeight: 449.517223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)C(=O)N(C2=O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)C(=O)N(C2=O)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F

InChI

InChI=1S/C26H28FN3O3/c1-26(2,3)17-4-6-19-21(14-17)25(32)30(24(19)31)13-12-29-10-8-16(9-11-29)23-20-7-5-18(27)15-22(20)33-28-23/h4-7,14-16H,8-13H2,1-3H3