5-tert-butyl-2-[1-(3-ethoxy-4-methoxy-phenyl)-2-(1,3,4-oxadiazol-2-yl)ethyl]isoindole-1,3-dione

Systemtic Name: 5-tert-butyl-2-[1-(3-ethoxy-4-methoxy-phenyl)-2-(1,3,4-oxadiazol-2-yl)ethyl]isoindole-1,3-dione Openeye Name: 5-tert-butyl-2-[1-(3-ethoxy-4-methoxy-phenyl)-2-(1,3,4-oxadiazol-2-yl)ethyl]isoindoline-1,3-dione CAS Name: 5-tert-butyl-2-[1-(3-ethoxy-4-methoxyphenyl)-2-(1,3,4-oxadiazol-2-yl)ethyl]isoindole-1,3-dione IUPAC Name: 5-tert-butyl-2-[1-(3-ethoxy-4-methoxyphenyl)-2-(1,3,4-oxadiazol-2-yl)ethyl]isoindole-1,3-dione Traditional Name: 5-tert-butyl-2-[1-(3-ethoxy-4-methoxy-phenyl)-2-(1,3,4-oxadiazol-2-yl)ethyl]isoindoline-1,3-quinone Formula: C25H27N3O5 MolecularWeight: 449.49898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(CC2=NN=CO2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(C)(C)C)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(CC2=NN=CO2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(C)(C)C)OC

InChI

InChI=1S/C25H27N3O5/c1-6-32-21-11-15(7-10-20(21)31-5)19(13-22-27-26-14-33-22)28-23(29)17-9-8-16(25(2,3)4)12-18(17)24(28)30/h7-12,14,19H,6,13H2,1-5H3