2-[[5-(3,5-ditert-butylphenyl)-1,3,4-oxadiazol-2-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[5-(3,5-ditert-butylphenyl)-1,3,4-oxadiazol-2-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[5-(3,5-ditert-butylphenyl)-1,3,4-oxadiazol-2-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[5-(3,5-ditert-butylphenyl)-1,3,4-oxadiazol-2-yl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[5-(3,5-ditert-butylphenyl)-1,3,4-oxadiazol-2-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[5-(3,5-ditert-butylphenyl)-1,3,4-oxadiazol-2-yl]methyl]isoindoline-1,3-quinone Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=NN=C(O2)CN3C(=O)C4=CC=CC=C4C3=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=NN=C(O2)CN3C(=O)C4=CC=CC=C4C3=O)C(C)(C)C

InChI

InChI=1S/C25H27N3O3/c1-24(2,3)16-11-15(12-17(13-16)25(4,5)6)21-27-26-20(31-21)14-28-22(29)18-9-7-8-10-19(18)23(28)30/h7-13H,14H2,1-6H3