3-(5-tert-butyl-2-oxidanyl-phenyl)carbonyl-2-(2,4-dimethylphenyl)-3H-isoindol-1-one

Systemtic Name: 3-(5-tert-butyl-2-oxidanyl-phenyl)carbonyl-2-(2,4-dimethylphenyl)-3H-isoindol-1-one Openeye Name: 3-(5-tert-butyl-2-hydroxy-benzoyl)-2-(2,4-dimethylphenyl)isoindolin-1-one CAS Name: 3-[(5-tert-butyl-2-hydroxyphenyl)-oxomethyl]-2-(2,4-dimethylphenyl)-3H-isoindol-1-one IUPAC Name: 3-(5-tert-butyl-2-hydroxybenzoyl)-2-(2,4-dimethylphenyl)-3H-isoindol-1-one Traditional Name: 3-(5-tert-butyl-2-hydroxy-benzoyl)-2-(2,4-dimethylphenyl)isoindolin-1-one Formula: C27H27NO3 MolecularWeight: 413.50818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(C3=CC=CC=C3C2=O)C(=O)C4=C(C=CC(=C4)C(C)(C)C)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(C3=CC=CC=C3C2=O)C(=O)C4=C(C=CC(=C4)C(C)(C)C)O)C

InChI

InChI=1S/C27H27NO3/c1-16-10-12-22(17(2)14-16)28-24(19-8-6-7-9-20(19)26(28)31)25(30)21-15-18(27(3,4)5)11-13-23(21)29/h6-15,24,29H,1-5H3